SCHEMBL9690499

SCHEMBL9690499

COc1cccc(CSc2nc3cnccc3[nH]2)c1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.83
NPC1 O15118 3/20 0.83
PKM P14618 1/20 0.83
SMN1; SMN2 Q16637 4/20 0.74
TP53 P04637 2/20 0.74
LMNA P02545 2/20 0.74
CYP2E1 P05181 10/20 0.63
CYP2C8 P10632 10/20 0.63
CYP2D6 P10635 10/20 0.63
CYP2C9 P11712 10/20 0.63
CYP2B6 P20813 10/20 0.63
CYP2C19 P33261 10/20 0.63
CYP3A4 P08684 9/20 0.63
CYP1A2 P05177 8/20 0.63
BRS3 P32247 1/20 0.57
KMT2A Q03164 2/20 0.57
NOS2 P35228 2/20 0.56
MEN1 O00255 1/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55

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
SCHEMBL9692851 0.90 NPC1 (0.67) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9690543 0.89 CYP2E1 (0.67) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9693004 0.89 RAB9A (0.66) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9339322 0.88 RAB9A (0.66) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9692749 0.87 CYP2D6 (0.65) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9693023 0.85 RAB9A (0.70) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL15693621 0.85 NPC1 (0.81) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9692982 0.85 RAB9A (0.62) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL9693079 0.84 RAB9A (0.60) RAB9ANPC1PKMSMN1; SMN2TP53
SCHEMBL25317747 0.82 RAB9A (0.82) RAB9ANPC1PKMSMN1; SMN2TP53

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
US-5081253-A IMIDAZO(4,5-C)PYRIDINES AS ANTIOSTEOPOROTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-01-14 US claimed
EP-0434405-A1 Imidazo[4,5-c]pyridines as antiosteoporotic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-06-26 EP claimed
US-5081253-A IMIDAZO(4,5-C)PYRIDINES AS ANTIOSTEOPOROTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-01-14 US disclosed
EP-0434405-A1 Imidazo[4,5-c]pyridines as antiosteoporotic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-06-26 EP disclosed
US-5001238-A Production of certain 2-phenylalkylthio-and 2-phenylalkylsulfinyl imidazo[4,]pyridines AMERICAN HOME PRODUCTS CORPORATION (US) 1991-03-19 US disclosed