SCHEMBL9635832

SCHEMBL9635832

OCCOc1ccc(-c2nc3cnccc3[nH]2)c(O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.42
PDE3B Q13370 4/20 0.42
PDE3A Q14432 4/20 0.42
P2RY12 Q9H244 3/20 0.42
PDE5A O76074 5/20 0.39
AMY1A P0DUB6 1/20 0.39
PDE2A O00408 2/20 0.38
MAOA P21397 1/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
CDK4 P11802 1/20 0.38
CCNA2 P20248 1/20 0.38
CCND1 P24385 1/20 0.38
CDK2 P24941 1/20 0.38
CCND3 P30281 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 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
SCHEMBL9636138 0.89 PDE5A (0.46) CHEK2PDE3BPDE3AP2RY12PDE5A
SCHEMBL9634973 0.87 CBFB (0.46) CHEK2PDE5AMGAMGAASI
SCHEMBL14601539 0.86 CHEK2 (0.46) CHEK2PDE3BPDE3AP2RY12PDE5A
SCHEMBL9634828 0.85 PDE5A (0.45) CHEK2PDE3BPDE3AP2RY12PDE5A
SCHEMBL9634947 0.85 PDE5A (0.46) CHEK2PDE3BPDE3APDE5AAMY1A
SCHEMBL9635668 0.84 LMNA (0.40) PDE3BPDE3APDE5AAMY1AMAOA
SCHEMBL9634572 0.84 ADORA2A (0.48) PDE3BPDE3AP2RY12AMY1APDE2A
SCHEMBL9635887 0.84 AMY1A (0.38) PDE3BPDE3APDE5AAMY1AMGAM
SCHEMBL9635821 0.84 CYP1A1 (0.38) PDE3BPDE3APDE5AAMY1AMAOA
SCHEMBL9635766 0.84 CHEK2 (0.55) CHEK2KDM4EALDH1A1HPGD

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 2 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