SCHEMBL9634580

SCHEMBL9634580

O=C(O)C[S+]([O-])c1cccc(-c2nc3cnccc3[nH]2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.43
ALDH1A1 P00352 7/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
HPGD P15428 5/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
HSD17B10 Q99714 2/20 0.40
FHIT P49789 1/20 0.40
KDM4C Q9H3R0 2/20 0.39
LDHA P00338 1/20 0.39
EPHX2 P34913 1/20 0.39
MMP2 P08253 4/20 0.39
MMP9 P14780 4/20 0.39
MMP8 P22894 4/20 0.39
MMP13 P45452 3/20 0.39
COMT P21964 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 4/20 0.38

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
SCHEMBL9635744 0.88 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9634362 0.86 HPSE (0.44) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9636075 0.86 PKN1 (0.43) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9634603 0.84 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9635757 0.84 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9636140 0.82 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9636465 0.82 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9634393 0.81 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9636133 0.81 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL9635824 0.80 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2HPGDRAB9A

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