SCHEMBL9635672

SCHEMBL9635672

CCOc1cccc(-c2nc3cnccc3[nH]2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
KDM4E B2RXH2 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
TP53 P04637 2/20 0.56
NPC1 O15118 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
RAB9A P51151 2/20 0.56
USP2 O75604 1/20 0.56
LMNA P02545 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
HSD17B10 Q99714 1/20 0.56
FGFR1 P11362 1/20 0.49
FGFR2 P21802 1/20 0.49
FGFR3 P22607 1/20 0.49
S1PR1 P21453 3/20 0.48
CBFB Q13951 1/20 0.47

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
SCHEMBL9634499 0.90 HDAC6 (0.49) MAPTKDM4ESMN1; SMN2TP53NPC1
SCHEMBL9634295 0.86 HDAC6 (0.53) MAPTKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL9634891 0.86 PDE3B (0.48) MAPTKDM4ESMN1; SMN2TP53NPC1
Hydrochloric Acid SCHEMBL7271945 0.85 AURKA (0.57) MAPTKDM4ESMN1; SMN2TP53NPC1
SCHEMBL10740103 0.85 MAPT (0.59) MAPTKDM4ESMN1; SMN2TP53NPC1
SCHEMBL9636105 0.84 HDAC6 (0.43) MAPTKDM4ESMN1; SMN2TP53NPC1
SCHEMBL9636045 0.84 HDAC6 (0.43) MAPTKDM4ESMN1; SMN2TP53NPC1
SCHEMBL9634643 0.84 MAOB (0.49) MAPTKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL9636406 0.84 ALDH1A1 (0.54) MAPTKDM4ESMN1; SMN2TP53NPC1
SCHEMBL9635899 0.83 MEN1 (0.53) MAPTKDM4ESMN1; SMN2TP53NPC1

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