SCHEMBL9634599

SCHEMBL9634599

O=C(O)CSc1cccc(-c2nc3cnccc3[nH]2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 4/20 0.45
KDM4E B2RXH2 8/20 0.45
ALDH1A1 P00352 7/20 0.45
HPGD P15428 7/20 0.45
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
KMT2A Q03164 4/20 0.45
NPC1 O15118 4/20 0.45
MAPT P10636 3/20 0.45
POLB P06746 2/20 0.45
MEN1 O00255 1/20 0.45
TP53 P04637 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
HSD17B10 Q99714 2/20 0.43
APEX1 P27695 1/20 0.42
FHIT P49789 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
TYMP P19971 1/20 0.41
LDHA P00338 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
SCHEMBL9634630 0.87 ALDH1A1 (0.48) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9634498 0.86 ALDH1A1 (0.51) GRK6KDM4EALDH1A1HPGDRAB9A
SCHEMBL9634638 0.85 ALDH1A1 (0.54) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9635805 0.84 KDM4E (0.42) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9634856 0.83 KDM4E (0.44) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9634555 0.81 KDM4E (0.42) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9634489 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9635788 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9634795 0.81 KDM4E (0.48) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9635698 0.79 ALOX5 (0.54) KDM4EALDH1A1HPGDRAB9ASMN1; 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 3 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-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed