SCHEMBL9710210

SCHEMBL9710210

CCCc1nc(C(N)C(=O)OCC)sc1Cc1ccc(N)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COPS5 Q92905 2/20 0.37
HSP90AA1 P07900 1/20 0.36
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAOA P21397 1/20 0.35
PPID Q08752 3/20 0.35
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 1/20 0.34
SHMT2 P34897 1/20 0.34
PPIB P23284 1/20 0.34
PPIA P62937 1/20 0.34
PPIG Q13427 1/20 0.34
XIAP P98170 2/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL9710190 0.86 RAB9A (0.41) LMNAMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL9457502 0.76 PPID (0.42) HSP90AA1LMNACYP1A2CYP3A4MAOA
SCHEMBL9458088 0.75 CYP3A4 (0.38) COPS5CYP1A2CYP3A4ALDH1A1NPC1
SCHEMBL9458014 0.75 MAPT (0.42) PPIDALDH1A1MAPTHPGDSHMT2
SCHEMBL9457422 0.74 COPS5 (0.44) COPS5CYP1A2CYP3A4ALDH1A1MAPT
SCHEMBL9710207 0.73 COPS5 (0.36) COPS5ALOX5AOC3
SCHEMBL9710206 0.73 COPS5 (0.36) COPS5HSP90AA1ALOX5XIAPAOC3
SCHEMBL9458127 0.73 HTT (0.40) COPS5ALDH1A1GAAHSD17B10HTT
SCHEMBL9458112 0.72 AOC3 (0.58) XIAPTSHRAOC3
SCHEMBL9458070 0.70 AOC3 (0.45) COPS5XIAPAOC3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992021666-A1 ANGIOTENSIN II RECEPTOR ANTAGONIST THIAZOLE DEVIVATIVES LABORATOIRES UPSA (FR) 1992-12-10 WO disclosed