SCHEMBL14641558

SCHEMBL14641558

CCCCC(=O)c1ccc2oc(=O)n(Cc3cccc(-c4ccc(N5CCN(C)CC5)nn4)c3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.46
▸ RAB9A P51151 6/20 0.46
▸ MIF P14174 2/20 0.40
▸ MAPT P10636 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PIM2 Q9P1W9 1/20 0.38
▸ TP53 P04637 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
SCHEMBL12241028 0.87 NPC1 (0.47) NPC1RAB9AMIFMAPTPOLB
SCHEMBL14641597 0.81 ASAH1 (0.39) MIFMAPTPOLBMEN1KMT2A
SCHEMBL12241023 0.81 POLB (0.46) NPC1RAB9AMIFMAPTPOLB
SCHEMBL12241027 0.79 POLB (0.46) NPC1RAB9AMIFMAPTPOLB
SCHEMBL12241035 0.75 PRKD1 (0.49) MAPTPOLBTP53
SCHEMBL12241030 0.72 POLB (0.44) MIFMAPTPOLBMEN1KMT2A
SCHEMBL12241260 0.72 POLB (0.48) MIFMAPTPOLBMEN1KMT2A
SCHEMBL2546995 0.71 MAPT (0.49) MIFMAPTPOLBMEN1KMT2A
SCHEMBL12241020 0.69 POLB (0.42) MIFMAPTPOLBMEN1KMT2A
SCHEMBL2544326 0.68 POLB (0.46) MIFMAPTPOLBTP53

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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