SCHEMBL9033129

SCHEMBL9033129

OC[C@@H]1CCCN1c1nc2ccc(Cl)cc2s1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.55
RAB9A P51151 6/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
CNR2 P34972 2/20 0.48
MAPT P10636 2/20 0.48
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
POLB P06746 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
PPARD Q03181 3/20 0.42
PPARG P37231 2/20 0.42
PPARA Q07869 1/20 0.42
CYP2C9 P11712 1/20 0.41

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
SCHEMBL9033137 1.00 NPC1 (0.55) NPC1RAB9ASMN1; SMN2CNR2MAPT
SCHEMBL5674922 0.82 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTADORA3
SCHEMBL9032005 0.82 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTADORA3
SCHEMBL5674913 0.82 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTADORA3
SCHEMBL10219837 0.78 NPC1 (0.65) NPC1RAB9ASMN1; SMN2CNR2MAPT
SCHEMBL9032458 0.77 NPC1 (0.44) NPC1RAB9ASMN1; SMN2CNR2MAPT
SCHEMBL9032465 0.77 NPC1 (0.44) NPC1RAB9ASMN1; SMN2CNR2MAPT
SCHEMBL6973188 0.76 NPC1 (0.56) NPC1RAB9ASMN1; SMN2CNR2MAPT
SCHEMBL2563234 0.76 NPC1 (0.50) NPC1RAB9ASMN1; SMN2CNR2MAPT
SCHEMBL2565667 0.76 NPC1 (0.50) NPC1RAB9ASMN1; SMN2CNR2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528734-B1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1996-10-23 EP disclosed
US-5330999-A Diabetes, obesity ADIR ET COMPAGNIE (FR) 1994-07-19 US disclosed
US-5296605-A 2,4-thiazolidinedione compounds ADIR ET COMPAGNIE (FR) 1994-03-22 US disclosed
US-5266582-A Antidiabetic agents ADIR ET COMPAGNIE (FR) 1993-11-30 US disclosed
EP-0528734-A1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-02-24 EP disclosed