SCHEMBL8418308

SCHEMBL8418308

CCC(=O)N1CCS(=O)(=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CHRNB2 P17787 3/20 0.41
CHRNA3 P32297 3/20 0.41
CHRNA4 P43681 3/20 0.41
CHRNB3 Q05901 1/20 0.41
CHRNA6 Q15825 1/20 0.41
EPHX2 P34913 3/20 0.41
CHRNB4 P30926 2/20 0.39
CHRNA7 P36544 2/20 0.39
RAB9A P51151 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35

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
SCHEMBL11408269 0.87 ALDH1A1 (0.39) BLMALDH1A1CHRNB2CHRNA3CHRNA4
SCHEMBL24010084 0.83 BLM (0.41) BLMALDH1A1CHRNB2CHRNA3CHRNA4
SCHEMBL12424223 0.83 L3MBTL1 (0.47) ALDH1A1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL18909098 0.82 EPHX2 (0.46) ALDH1A1EPHX2MEN1KMT2ATDP1
SCHEMBL180620 0.80
SCHEMBL2739418 0.80 BLM (0.57) BLMALDH1A1CHRNB2CHRNA3CHRNA4
SCHEMBL20756575 0.80 BLM (0.57) BLMALDH1A1CHRNB2CHRNA3CHRNA4
SCHEMBL18557477 0.79 L3MBTL1 (0.58) MEN1KMT2AL3MBTL1TDP1
SCHEMBL9028343 0.79 AKR1C3 (0.36) ALDH1A1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL9028339 0.79 RAB9A (0.35) ALDH1A1RAB9AMEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 US disclosed
US-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE HERCULES CAPITAL, INC., AS AGENT 2023-08-24 US disclosed
WO-2023098825-A1 SOS1 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 勤浩医药(苏州)有限公司 2023-06-08 WO disclosed
EP-3402785-B1 3-(CARBOXYMETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2020-02-26 EP disclosed
EP-3169666-B1 SUBSTITUTED AZASPIRO(4.5)DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2018-06-06 EP disclosed
US-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2017-07-27 US disclosed
WO-2017121649-A1 3-(CARBOXYMETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES Grünenthal GmbH (DE) 2017-07-20 WO disclosed
US-9657015-B2 Substituted bicyclic dihydropyrimidinones and their use as inhibitors of neutrophil elastase activity BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-05-23 US disclosed
US-9657015-B2 Substituted bicyclic dihydropyrimidinones and their use as inhibitors of neutrophil elastase activity BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-05-23 US disclosed
US-9656962-B2 Ring-contracted morphinans and the use thereof PURDUE PHARMA L.P. (US) 2017-05-23 US disclosed
WO-2011038162-A1 PYRIDO(3,4-B)INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2011-03-31 WO disclosed
US-20110008286-A1 NOVEL PROLINE SUBSTITUTED CYCLOSPORIN ANALOGUES ENANTA PHARMACEUTICALS, INC. 2011-01-13 US disclosed
US-20110008285-A1 NOVEL CYCLOSPORIN ANALOGUES ENANTA PHARMACEUTICALS, INC. 2011-01-13 US disclosed
US-7618973-B2 Isoxazolo-pyrazine derivatives HOFFMANN-LA ROCHE INC. (US) 2009-11-17 US disclosed
WO-2009120720-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES,INC. (US) 2009-10-01 WO disclosed
US-20090143407-A1 ISOXAZOLO-PYRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
US-7326709-B2 Bicyclic and tricyclic heteroaromatic compounds NEUROGEN CORPORATION (US) 2008-02-05 US disclosed
WO-2007127726-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 WO disclosed
WO-2007124254-A2 CYCLOHEXYLPYRAZOLE-LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-01 WO disclosed
US-20070219196-A1 AMIDE SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2007-09-20 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-20090143407-A1 ISOXAZOLO-PYRAZINE DERIVATIVES GABRA5, CHRNA5, GABRA4 BLM 4811/4885ALDH1A1 1772/4885CHRNB2 90/4885
US-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE APOL1, APOB, LDLR BLM 3527/4885ALDH1A1 2642/4885CHRNB2 1629/4885
US-20230348369-A1 NAMPT MODULATORS NAMPT, NNT, NAPRT BLM 4802/4885ALDH1A1 982/4885CHRNB2 2750/4885
US-20070219196-A1 AMIDE SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES IL2, IL4, IFNG BLM 1951/4885ALDH1A1 1449/4885CHRNB2 4460/4885
US-20110008286-A1 NOVEL PROLINE SUBSTITUTED CYCLOSPORIN ANALOGUES FKBP1A, FKBP8, FKBP1B BLM 4325/4885ALDH1A1 3628/4885CHRNB2 4876/4885
US-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRM1, OPRD1 BLM 4874/4885ALDH1A1 359/4885CHRNB2 569/4885
US-20110008285-A1 NOVEL CYCLOSPORIN ANALOGUES HAVCR2, CHP1, TSLP BLM 2836/4885ALDH1A1 4522/4885CHRNB2 4734/4885

“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.