SCHEMBL5293272

SCHEMBL5293272

O=COCCN1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CXCR4 P61073 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LTA4H P09960 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ANPEP P15144 1/20 0.36
ERAP2 Q6P179 1/20 0.36
RAD52 P43351 1/20 0.34
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL5290984 0.89 MEN1 (0.44) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL272713 0.88 CXCR4 (0.46) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL5544476 0.86 CXCR4 (0.47) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
Hydrochloric Acid SCHEMBL27805378 0.85 CXCR4 (0.46) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL20407546 0.84
SCHEMBL27746939 0.80
SCHEMBL64778 0.80 HRH3 (0.39) POLBMEN1KMT2ALTA4HALDH1A1
SCHEMBL5236146 0.78 SMN1; SMN2 (0.34) SIGMAR1POLBSMN1; SMN2CXCR4MEN1
SCHEMBL271825 0.78 HRH3 (0.42) POLBSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL28110383 0.78 HRH3 (0.42) POLBSMN1; SMN2MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527270-B Medical intermediate of PROTAC molecule targeting monoacylglycerol lipase, preparation method and application 河南大学 2024-03-01 CN claimed
CN-113527270-A Medicine intermediate of PROTAC molecule of targeted monoacylglycerol lipase, preparation method and application 河南大学 2021-10-22 CN claimed
CN-109705033-A N- heteroaryl sulfonamide analog derivative and preparation and application 杭州壹瑞医药科技有限公司 2019-05-03 CN claimed
CN-109516969-A One kind coumarin derivative containing carboxyl and its synthetic method and application 山西大学 2019-03-26 CN claimed
EP-2758051-B1 CYANOMETHYLPYRAZOLE CARBOXAMIDES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2018-04-11 EP claimed
US-9328099-B2 Cyanomethylpyrazole carboxamides as janus kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2016-05-03 US claimed
CN-102656165-B Glycoside derivatives and uses thereof NOVARTIS AG 2015-02-11 CN claimed
US-20140228348-A1 CYANOMETHYLPYRAZOLE CARBOXAMIDES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME LLC 2014-08-14 US claimed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP claimed
CN-102656165-A Glycoside derivatives and uses thereof NOVARTIS AG 2012-09-05 CN claimed
CN-101035525-A Substituted urea derivatives for the treatment of cardiac diseases CYTOKINETICS INC (US) 2007-09-12 CN claimed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US claimed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US claimed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP claimed
US-20040147561-A1 Pyrid-2-one derivatives and methods of use SYNGENTA CROP PROTECTION AG (CH) 2004-07-29 US claimed
EP-0171217-B1 FUSED-RING HETEROCYCLIC COMPOUNDS A PROCESS FOR THEIR PRODUCTION AND THEIR PHARMACEUTICAL USE SANKYO COMPANY LIMITED (JP) 1989-05-03 EP claimed
US-4716162-A BRAIN FUNCTION SANKYO COMPANY, LIMITED (JP) 1987-12-29 US claimed
EP-0171217-A2 Fused-ring heterocyclic compounds a process for their production and their pharmaceutical use SANKYO COMPANY LIMITED (JP) 1986-02-12 EP claimed
CN-113527270-B Medical intermediate of PROTAC molecule targeting monoacylglycerol lipase, preparation method and application 河南大学 2024-03-01 CN disclosed
EP-0016746-A1 New therapeutically active spirocycloalkylamines and pharmaceutical preparations comprising such compounds Astra Läkemedel Aktiebolag (SE) 1980-10-01 EP 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 (3 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 SIGMAR1 234/4885POLB 1637/4885SMN1; SMN2 3985/4885
US-20140228348-A1 CYANOMETHYLPYRAZOLE CARBOXAMIDES AS JANUS KINASE INHIBITORS JAK1, JAK2, JAK3 SIGMAR1 1953/4885POLB 2976/4885SMN1; SMN2 4782/4885
US-20040147561-A1 Pyrid-2-one derivatives and methods of use PLPBP, PNPO, PDXK SIGMAR1 4091/4885POLB 912/4885SMN1; SMN2 88/4885

“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.