SCHEMBL9635683

SCHEMBL9635683

C#CCSc1ccc(-c2nc3cnccc3[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.44
ALDH1A1 P00352 8/20 0.44
RAB9A P51151 6/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
NPC1 O15118 5/20 0.44
HPGD P15428 5/20 0.44
PKM P14618 2/20 0.44
PKN1 Q16512 2/20 0.41
PKN2 Q16513 2/20 0.41
AURKA O14965 1/20 0.41
HPSE Q9Y251 1/20 0.39
LDHA P00338 1/20 0.39
EPHX2 P34913 1/20 0.39
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
KMT2A Q03164 1/20 0.37
CHEK1 O14757 1/20 0.36
PRKD3 O94806 1/20 0.36

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
SCHEMBL9634557 0.87 KDM4E (0.52) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL9635788 0.85 KDM4E (0.41) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL10742133 0.84 CHEK1 (0.38) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL9635741 0.83 AURKA (0.47) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL9634693 0.81 AURKA (0.45) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL9635679 0.81 ALDH1A1 (0.48) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL9635746 0.80 ALDH1A1 (0.44) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL9635715 0.79 PDE5A (0.47) KDM4EALDH1A1HPGDHPSE
SCHEMBL9634498 0.79 ALDH1A1 (0.51) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL7272011 0.78 ALOX5 (0.51) KDM4EALDH1A1RAB9ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104881-A 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-04-14 US disclosed
US-4616090-A 2-arylimidazopyridines intermediates MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-07 US disclosed
EP-0072926-B1 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GmbH (DE) 1986-09-24 EP disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed