SCHEMBL3629237

SCHEMBL3629237

COC(=O)Oc1ccc2c(c1)oc(=O)n2Cc1cccc(N)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 8/20 0.52
POLB P06746 1/20 0.51
MIF P14174 6/20 0.50
CD74 P04233 3/20 0.50
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PLA2G2A P14555 1/20 0.46
BRAF P15056 1/20 0.44
NPC1 O15118 1/20 0.44
ABHD6 Q9BV23 1/20 0.43

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
SCHEMBL3629990 0.85 IDO1 (0.52) TNIKPOLBMIFCD74MEN1
SCHEMBL2548789 0.83 MIF (0.52) TNIKPOLBMIFCD74MEN1
SCHEMBL3632389 0.82 MIF (0.47) TNIKPOLBMIFCD74BRAF
SCHEMBL2547710 0.78 MIF (0.75) TNIKPOLBMIFCD74MEN1
SCHEMBL3627242 0.78 MIF (0.53) POLBMIFCD74MEN1KMT2A
SCHEMBL2548545 0.76 IDO1 (0.59) TNIKPOLBMIFCD74MEN1
SCHEMBL28782675 0.76 IDO1 (0.53) TNIKPOLBMIFCD74PLA2G2A
SCHEMBL14563237 0.75 MIF (0.60) TNIKPOLBMIFCD74
SCHEMBL13981971 0.73 SIGMAR1 (0.48) TNIKPOLBMIFKMT2ANPC1
SCHEMBL3633664 0.73 MIF (0.48) TNIKPOLBMIFCD74BRAF

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-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
EP-2150551-A1 2-OXO-3-BENZYL-BENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMORS Merck Patent GmbH (DE) 2010-02-10 EP disclosed
WO-2008148449-A1 2-OXO-3-BENZYL-BENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2008-12-11 WO disclosed