SCHEMBL224885

SCHEMBL224885

CON(C)C(=O)c1cccc(B(O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MLYCD O95822 1/20 0.41
NLRP3 Q96P20 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TTR P02766 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B2 P37059 1/20 0.38
MGLL Q99685 1/20 0.37
GPR183 P32249 1/20 0.36
ERN1 O75460 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29957433 1.00 ENPP2 (0.46) ENPP2MEN1KMT2AMLYCDNLRP3
SCHEMBL15281239 0.84 KMT2A (0.50) MEN1KMT2AMLYCDTRPM8LMNA
SCHEMBL29902315 0.83 ERN1 (0.48) ENPP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL177412 0.83 ERN1 (0.48) ENPP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL29729945 0.80 CES2 (0.53) MEN1KMT2AMLYCDKDM4EALDH1A1
SCHEMBL305837 0.80 CES2 (0.53) MEN1KMT2AMLYCDKDM4EALDH1A1
SCHEMBL130927 0.80 MLYCD (0.53) ENPP2MLYCDKDM4EALDH1A1HPGD
SCHEMBL16214051 0.80 MEN1 (0.46) MEN1KMT2AMLYCDALDH1A1HPGD
SCHEMBL32424912 0.78 HPGD (0.57) MEN1KMT2AMLYCDHPGDHSD17B2
SCHEMBL2652369 0.78 HPGD (0.57) MEN1KMT2AMLYCDHPGDHSD17B2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144767-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-05-11 US disclosed
US-20210371460-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-12-02 US disclosed
US-10751273-B2 Compounds for the treatment of pathologies associated with aging and degenerative disorders University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2020-08-25 US disclosed
US-20190210969-A1 INTRAESOPHAGEAL ADMINISTRATION OF TARGETED NITROXIDE AGENTS FOR PROTECTION AGAINST IONIZING IRRADIATION-INDUCED ESOPHAGITIS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2019-07-11 US disclosed
US-20180298054-A1 TARGETED NITROXIDE AGENTS University of Pittsburgh - of the Commonwealth Sys tem of Higher Education (US) 2018-10-18 US disclosed
US-9890192-B2 Targeted nitroxide agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2018-02-13 US disclosed
US-9732105-B2 Targeted nitroxide agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2017-08-15 US disclosed
US-20160151269-A1 COMPOUNDS FOR THE TREATMENT OF PATHOLOGIES ASSOCIATED WITH AGING AND DEGENERATIVE DISORDERS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-06-02 US disclosed
US-20160137692-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-05-19 US disclosed
US-20160068556-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-03-10 US disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-8288551-B2 Targeted nitroxide agents UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-10-16 US disclosed
US-20120252733-A1 USE OF TARGETED NITROXIDE AGENTS IN BONE HEALING UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-10-04 US disclosed
US-20120207687-A1 TOPICAL FORMULATIONS OF TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2012-08-16 US disclosed
US-20120004263-A1 Compounds for the treatment of pathologies associated with aging and degenerative disorders UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-01-05 US disclosed
US-20110172214-A1 USE OF TARGETED NITROXIDE AGENTS IN PREVENTING, MITIGATING AND TREATING RADIATION INJURY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2011-07-14 US disclosed
WO-2010141824-A2 USE OF TARGETED NITROXIDE AGENTS IN BONE HEALING UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2010-12-09 WO disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100035869-A1 TARGETED NITROXIDE AGENTS PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION, UNIVERSITY OF 2010-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110172214-A1 USE OF TARGETED NITROXIDE AGENTS IN PREVENTING, MITIGATING AND TREATING RADIATION INJURY TXNRD2, TXN2, HSPE1 ENPP2 2379/4885MEN1 3690/4885KMT2A 3662/4885
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD ENPP2 1363/4885MEN1 859/4885KMT2A 4408/4885
US-20190210969-A1 INTRAESOPHAGEAL ADMINISTRATION OF TARGETED NITROXIDE AGENTS FOR PROTECTION AGAINST IONIZING IRRADIATION-INDUCED ESOPHAGITIS HSPE1, HSPA9, HSPD1 ENPP2 1651/4885MEN1 2497/4885KMT2A 4317/4885
US-20160151269-A1 COMPOUNDS FOR THE TREATMENT OF PATHOLOGIES ASSOCIATED WITH AGING AND DEGENERATIVE DISORDERS GLA, AGER, SIRT1 ENPP2 662/4885MEN1 3812/4885KMT2A 3286/4885
US-20120207687-A1 TOPICAL FORMULATIONS OF TARGETED NITROXIDE AGENTS NOX1, OGG1, NOX5 ENPP2 1905/4885MEN1 4054/4885KMT2A 2809/4885
US-20160137692-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 ENPP2 2178/4885MEN1 3895/4885KMT2A 3194/4885
US-20120004263-A1 Compounds for the treatment of pathologies associated with aging and degenerative disorders GLA, AGER, SIRT1 ENPP2 662/4885MEN1 3812/4885KMT2A 3286/4885
US-20180298054-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 ENPP2 2178/4885MEN1 3895/4885KMT2A 3194/4885
US-20100035869-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 ENPP2 2178/4885MEN1 3895/4885KMT2A 3194/4885
US-10751273-B2 Compounds for the treatment of pathologies associated with aging and degenerative disorders GLA, AGER, SIRT1 ENPP2 662/4885MEN1 3812/4885KMT2A 3286/4885
US-20120252733-A1 USE OF TARGETED NITROXIDE AGENTS IN BONE HEALING NME4, TFAM, COX5B ENPP2 922/4885MEN1 4693/4885KMT2A 4433/4885
US-20230144767-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 ENPP2 2178/4885MEN1 3895/4885KMT2A 3194/4885
US-20210371460-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 ENPP2 2178/4885MEN1 3895/4885KMT2A 3194/4885
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA ENPP2 1278/4885MEN1 2762/4885KMT2A 2175/4885
US-20160068556-A1 TARGETED NITROXIDE AGENTS NOXO1, NOX1, TPX2 ENPP2 583/4885MEN1 3838/4885KMT2A 2011/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.