SCHEMBL14641623

SCHEMBL14641623

Cc1ccc2c(n1)N(Cc1cccc(-c3ncc(OC4CCN(C)CC4)cn3)c1)C(=O)C2

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 3/20 0.42
▸ NQO2 P16083 1/20 0.42
▸ USP1 O94782 12/20 0.39
▸ HCRTR1 O43613 2/20 0.38
▸ HCRTR2 O43614 2/20 0.38
▸ BMPR1B O00238 1/20 0.37
▸ BMPR1A P36894 1/20 0.37
▸ ACVR1B P36896 1/20 0.37
▸ ACVRL1 P37023 1/20 0.37
▸ ACVR1 Q04771 1/20 0.37
▸ F10 P00742 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
SCHEMBL14641562 0.93 MET (0.42) METNQO2USP1HCRTR1HCRTR2
SCHEMBL14641587 0.81 USP1 (0.41) METUSP1
SCHEMBL14641622 0.81 MET (0.52) METUSP1BMPR1AACVRL1ACVR1
SCHEMBL12241151 0.80 MET (0.41) METNQO2USP1BMPR1BBMPR1A
SCHEMBL14641564 0.78 USP1 (0.43) METUSP1
SCHEMBL14641588 0.78 USP1 (0.43) METUSP1
SCHEMBL12547481 0.76 MAP4K1 (0.44) METNQO2
SCHEMBL12547624 0.76 MAP4K1 (0.44) METNQO2ACVR1
SCHEMBL1581330 0.74 MET (0.59) METNQO2
SCHEMBL12241225 0.72 USP1 (0.40) METNQO2USP1

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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