SCHEMBL9634736

SCHEMBL9634736

C#CCOc1cc(OC)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.47
PDE5A O76074 4/20 0.44
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
AMY1A P0DUB6 3/20 0.40
ACHE P22303 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
RUNX1 Q01196 1/20 0.38
AURKA O14965 1/20 0.38
KDR P35968 1/20 0.38
TOP1 P11387 1/20 0.38
TOP2A P11388 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
CHUK O15111 1/20 0.37
FGFR1 P11362 1/20 0.37

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
SCHEMBL9634591 0.92 TOP1 (0.40) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL9634540 0.92 PDE5A (0.47) PDE2APDE5APDE3BPDE3AAMY1A
SCHEMBL9634342 0.92 PDE5A (0.41) PDE2APDE5APDE3BPDE3AAMY1A
SCHEMBL9634624 0.91 CBFB (0.41) PDE2APDE5APDE3BPDE3ANPC1
SCHEMBL9636160 0.89 PDE2A (0.47) PDE2APDE5APDE3BPDE3AAMY1A
SCHEMBL9634582 0.88 PDE5A (0.40) PDE2APDE5APDE3BPDE3ANPC1
SCHEMBL9635731 0.88 TOP1 (0.37) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL9634126 0.88 TOP1 (0.37) PDE2APDE5APDE3BPDE3AACHE
SCHEMBL10739019 0.87 PDE2A (0.46) PDE2APDE5APDE3BPDE3AAMY1A
SCHEMBL7272286 0.87 PDE2A (0.50) PDE2APDE5APDE3BPDE3AAMY1A

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