SCHEMBL2547731

SCHEMBL2547731

CN1CCN(CCCN(C(=O)O)c2cccc(Cn3c(=O)oc4ccc(C#N)cc43)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.46
CDY1; CDY1B Q9Y6F8 3/20 0.44
CBX7 O95931 2/20 0.44
CDYL2 Q8N8U2 2/20 0.44
CDYL Q9Y232 1/20 0.41
SIGMAR1 Q99720 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
MIF P14174 3/20 0.40
MAPKAPK2 P49137 1/20 0.39
CCR5 P51681 2/20 0.39
CD74 P04233 1/20 0.39
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38

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
SCHEMBL2540918 0.89 POLB (0.54) SIGMAR1KMT2AMEN1POLBMIF
SCHEMBL2542689 0.88 SIGMAR1 (0.54) KMOSIGMAR1KMT2ANOS3NOS1
SCHEMBL2546966 0.88 TP53 (0.48) KMT2AMEN1POLBMIF
SCHEMBL2544317 0.87 MAPT (0.43) SIGMAR1KMT2AMEN1POLBMIF
SCHEMBL2540729 0.86 MIF (0.55) KMOCDY1; CDY1BCBX7CDYL2CDYL
SCHEMBL2544331 0.86 SIGMAR1 (0.40) SIGMAR1KMT2AMEN1POLBMIF
SCHEMBL3730374 0.86 MIF (0.41) SIGMAR1KMT2AMEN1POLBMIF
SCHEMBL2542601 0.86 SIGMAR1 (0.42) SIGMAR1KMT2AMEN1POLBMIF
SCHEMBL2540868 0.85 IDO1 (0.40) SIGMAR1KMT2AMEN1POLBMIF
SCHEMBL2544025 0.84 MIF (0.53) SIGMAR1KMT2AMEN1POLBMIF

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 5 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 claimed
US-8071593-B2 2-oxo-3-benzylbenzoxazol-2-one derivatives and related compounds as Met kinase inhibitors for the treatment of tumours MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-12-06 US claimed
US-20100280030-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-11-04 US claimed
US-8431572-B2 2-oxo-3-benzylbenzoxazol-2-one derivatives and related compounds as met kinase inhibitors for the treatment of tumours MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-30 US disclosed
US-20110263596-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS SCHADT OLIVER 2011-10-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100280030-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS ERBB2, RET, MET KMO 823/4885CDY1; CDY1B 1525/4885CBX7 1475/4885
US-20110263596-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS MET, RET, ERBB2 KMO 738/4885CDY1; CDY1B 1771/4885CBX7 1952/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.