SCHEMBL7550066

SCHEMBL7550066

Nc1ncnc2sc(CN3CCN(Cc4cc5ccc(Cl)cc5s4)CC3=O)cc12

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 18/20 0.53
▸ ADORA2A P29274 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 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
SCHEMBL1652757 0.86 F10 (0.53) F10
SCHEMBL1651739 0.85 F10 (0.73) F10
SCHEMBL1651200 0.84 F10 (0.73) F10
SCHEMBL1652299 0.81 F10 (0.56) F10
SCHEMBL27551294 0.80 F10 (0.41) F10ADORA2AADORA1MEN1KMT2A
SCHEMBL1651389 0.79 F10 (0.77) F10
SCHEMBL1652546 0.78 F10 (0.68) F10
SCHEMBL1653049 0.78 F10 (0.53) F10
SCHEMBL1651499 0.76 F10 (0.63) F10
SCHEMBL27572835 0.76 F10 (0.44) F10

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
EP-1051176-A4 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARM PROD INC (US) 2002-06-12 — — EP disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 — — EP disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 — — WO disclosed
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