SCHEMBL14641588

SCHEMBL14641588

C=C(COc1cnc(-c2cccc(CN3C(=O)Cc4ccc(C)nc43)c2)nc1)N1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 17/20 0.43
▸ MET P08581 2/20 0.38
▸ PIK3CA P42336 1/20 0.35
▸ MTOR P42345 1/20 0.35

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
SCHEMBL14641622 0.85 MET (0.52) USP1MET
SCHEMBL14641587 0.81 USP1 (0.41) USP1MET
SCHEMBL14641623 0.78 MET (0.42) USP1MET
SCHEMBL14641564 0.76 USP1 (0.43) USP1MET
SCHEMBL14641562 0.75 MET (0.42) USP1MET
SCHEMBL12241240 0.73 ALDH1A1 (0.42) MET
SCHEMBL12241122 0.66 MET (0.52) MET
SCHEMBL3083882 0.65 MET (0.58) MET
SCHEMBL12547692 0.63 MET (0.53) MET
SCHEMBL13981975 0.63 MET (0.51) MET

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2150551-B1 2-OXO-3-BENZYL-BENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2013-01-16 — — EP disclosed
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