SCHEMBL5293345

SCHEMBL5293345

COC(=O)c1cc(-c2ccccc2)no1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.63
RAB9A P51151 5/20 0.63
KDM4E B2RXH2 2/20 0.58
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.51
MAPT P10636 3/20 0.51
NPC1 O15118 3/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTGS1 P23219 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.47
NOTUM Q6P988 1/20 0.46

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
SCHEMBL8880347 0.86 MAPT (0.52) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL13363878 0.86 CYP46A1 (0.49) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL15919469 0.86 MAPT (0.60) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL20507127 0.85 MAPT (0.56) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL30516592 0.85 CYP19A1 (0.51) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL13363888 0.85 CYP19A1 (0.51) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL17652591 0.84 MAPT (0.60) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL2724085 0.84 SMN1; SMN2 (0.66) SMN1; SMN2RAB9AKDM4EMEN1KMT2A
SCHEMBL1544560 0.84 MAPT (0.55) SMN1; SMN2RAB9AALDH1A1GAAMAPT
SCHEMBL214283 0.84 MEN1 (0.49) SMN1; SMN2RAB9AKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240139158-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS PROTEOSTASIS THERAPEUTICS INC (US) 2024-05-02 US disclosed
EP-3237411-B1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS INC (US) 2023-06-07 EP disclosed
US-20220175735-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS PROTEOSTASIS THERAPEUTICS INC (US) 2022-06-09 US disclosed
US-20220175735-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS PROTEOSTASIS THERAPEUTICS INC (US) 2022-06-09 US disclosed
CN-107207487-B Compounds, compositions and methods for increasing CFTR activity 蛋白质平衡治疗股份有限公司 2021-12-28 CN disclosed
US-11083709-B2 Compounds, compositions, and methods of increasing CFTR activity PROTEOSTASIS THERAPEUTICS, INC. (US) 2021-08-10 US disclosed
US-11083709-B2 Compounds, compositions, and methods of increasing CFTR activity PROTEOSTASIS THERAPEUTICS, INC. (US) 2021-08-10 US disclosed
US-20200360348-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2020-11-19 US disclosed
US-20200360348-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2020-11-19 US disclosed
US-20200190072-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2020-06-18 US disclosed
US-20160128984-A1 ISOXAZOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB, LLC 2016-05-12 US disclosed
US-20160128984-A1 ISOXAZOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB, LLC 2016-05-12 US disclosed
US-20160128984-A1 ISOXAZOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB, LLC 2016-05-12 US disclosed
WO-2016054560-A1 ISOXAZOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2016-04-07 WO disclosed
WO-2016054560-A1 ISOXAZOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2016-04-07 WO disclosed
WO-2014160668-A1 TETRAHYDROISOQUINOLINES CONTAINING SUBSTITUTED AZOLES AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-10-02 WO disclosed
EP-2691379-A1 HERBICIDALLY AND FUNGICIDALLY ACTIVE 3-PHENYLISOXAZOLINE-5-CARBOXAMIDES AND 3-PHENYLISOXAZOLINE-5-THIOAMIDES Bayer Intellectual Property GmbH (DE) 2014-02-05 EP disclosed
WO-2012130798-A1 HERBICIDALLY AND FUNGICIDALLY ACTIVE 3-PHNEYLISOXAZOLINE-5-CARBOXAMIDES AND 3-PHNEYLISOXAZOLINE-5-THIOAMIDES BAYER CROPSCIENCE AG (DE) 2012-10-04 WO disclosed
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 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 (7 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-20240139158-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS SMPD1, ELANE, SMPD2 SMN1; SMN2 1913/4885RAB9A 1690/4885KDM4E 4489/4885
US-20200360348-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF INCREASING CFTR ACTIVITY CFTR, ABCB4, SCNN1B SMN1; SMN2 3701/4885RAB9A 840/4885KDM4E 4684/4885
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 SMN1; SMN2 3894/4885RAB9A 20/4885KDM4E 4305/4885
US-20200190072-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INCREASING CFTR ACTIVITY CFTR, SCNN1B, SCNN1G SMN1; SMN2 4744/4885RAB9A 715/4885KDM4E 4657/4885
US-20160128984-A1 ISOXAZOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SERPINB1, ELANE SMN1; SMN2 3370/4885RAB9A 3589/4885KDM4E 4302/4885
US-11083709-B2 Compounds, compositions, and methods of increasing CFTR activity CFTR, ABCB4, SCNN1B SMN1; SMN2 3701/4885RAB9A 840/4885KDM4E 4684/4885
US-20220175735-A1 METHODS OF TREATING PULMONARY DISEASES AND DISORDERS SMPD1, ELANE, SMPD2 SMN1; SMN2 1913/4885RAB9A 1690/4885KDM4E 4489/4885

“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.