SCHEMBL14641589

SCHEMBL14641589

CCNC(=O)c1ccc2c(c1)N(Cc1cccc(-c3ncc(OCC4CCN(C)CC4)cn3)c1)C(=O)C2

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 3/20 0.49
▸ NQO2 P16083 1/20 0.49
▸ KDR P35968 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ CHRM3 P20309 3/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ AVPR1B P47901 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ GSK3B P49841 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
SCHEMBL13981975 0.90 MET (0.51) METNQO2SMN1; SMN2CHRM3AVPR1B
SCHEMBL12265755 0.81 MET (0.48) METNQO2BRD4POLB
SCHEMBL14641595 0.78 POLB (0.39) SMN1; SMN2ROCK2CHRM3POLB
SCHEMBL12265753 0.75 MET (0.47) METNQO2POLBMAP4K4
SCHEMBL13981879 0.75 ACHE (0.37) ACHE
SCHEMBL22309754 0.74 MET (0.58) METNQO2SMN1; SMN2ACHE
SCHEMBL12266108 0.74 MET (0.47) METNQO2POLBMAP4K4
SCHEMBL1296276 0.74 MET (0.57) METNQO2CHRM3ACHE
SCHEMBL12266116 0.73 MET (0.49) METNQO2POLB
SCHEMBL31495087 0.72 MET (0.57) METNQO2ACHE

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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