SCHEMBL9635679

SCHEMBL9635679

OCCSc1ccc(-c2nc3cnccc3[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
KDM4E B2RXH2 8/20 0.48
RAB9A P51151 5/20 0.48
HPGD P15428 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
NPC1 O15118 4/20 0.48
PKM P14618 2/20 0.48
HPSE Q9Y251 1/20 0.45
AURKA O14965 1/20 0.45
PKN1 Q16512 1/20 0.42
PKN2 Q16513 1/20 0.42
CHEK1 O14757 1/20 0.40
PRKD3 O94806 1/20 0.40
PAK4 O96013 1/20 0.40
PDGFRA P16234 1/20 0.40
LTK P29376 1/20 0.40
MAP2K2 P36507 1/20 0.40
MAPK8 P45983 1/20 0.40
CDK8 P49336 1/20 0.40
RPS6KA3 P51812 1/20 0.40

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
SCHEMBL9634693 0.87 AURKA (0.45) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9635805 0.85 KDM4E (0.42) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9635741 0.84 AURKA (0.47) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9634498 0.82 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9635683 0.81 KDM4E (0.44) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9635746 0.81 ALDH1A1 (0.44) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9634557 0.81 KDM4E (0.52) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9635766 0.80 CHEK2 (0.55) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL7272011 0.79 ALOX5 (0.51) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2
SCHEMBL9634874 0.78 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9AHPGDSMN1; SMN2

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