SCHEMBL206143

SCHEMBL206143

NC(=O)c1c(Cl)ccc(O)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.42
PKMYT1 Q99640 3/20 0.40
WEE1 P30291 2/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CXCR2 P25025 2/20 0.39
CXCR1 P25024 1/20 0.39
MAPK1 P28482 2/20 0.38
CYP3A4 P08684 1/20 0.38
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
CDC7 O00311 1/20 0.37
EEF2K O00418 1/20 0.37
PLK4 O00444 1/20 0.37
AURKA O14965 1/20 0.37
DAPK3 O43293 1/20 0.37
ROCK2 O75116 1/20 0.37
RPS6KA5 O75582 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 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
SCHEMBL6129712 0.82 THRB (0.43) DPP4CA1CA2MAPK1CYP3A4
SCHEMBL5173385 0.81 CYP3A4 (0.50) DPP4PKMYT1WEE1CA1CA2
SCHEMBL17825633 0.78 PBRM1 (0.45) DPP4CXCR2CXCR1KMT2AATM
SCHEMBL6741177 0.78 POLB (0.43) DPP4PKMYT1CXCR2CXCR1CYP3A4
SCHEMBL202186 0.78 HSD17B1 (0.46) DPP4PKMYT1WEE1CXCR2CXCR1
SCHEMBL9833894 0.77 CNR2 (0.45) DPP4MAPK1KMT2AATMPBRM1
SCHEMBL8587726 0.76 DPP4 (0.64) DPP4PKMYT1WEE1CXCR2CXCR1
SCHEMBL206180 0.75 DPP4 (0.47) DPP4PKMYT1WEE1CA1CA2
SCHEMBL28060147 0.75 PKMYT1 (0.42) PKMYT1WEE1CDK1HSD17B10TSHR
SCHEMBL8932346 0.75 SLC6A2 (0.36) DPP4MAPK1KMT2AATMCDC7

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101998959-B Benzoxazole carboxamide inhibitors of poly(ADP-ribose)polymerase (PARP) BIOMARIN PHARM INC 2013-08-28 CN disclosed
US-8088760-B2 Benzoxazole carboxamide inhibitors of poly(ADP-ribose)polymerase (PARP) BIOMARIN PHARMACEUTICAL INC. (US) 2012-01-03 US disclosed
CN-101998959-A Benzoxazole carboxamide inhibitors of poly(ADP-ribose)polymerase (PARP) LEAD THERAPEUTICS INC 2011-03-30 CN disclosed
EP-2247600-A2 BENZOXAZOLE CARBOXAMIDE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) Lead Therapeutics, Inc. (US) 2010-11-10 EP disclosed
WO-2009099736-A2 BENZOXAZOLE CARBOXAMIDE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) LEAD THERAPEUTICS, INC. (US) 2009-08-13 WO disclosed
US-20090197863-A1 BENZOXAZOLE CARBOXAMIDE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) LEAD THERAPEUTICS, INC. (US) 2009-08-06 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 (1 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-20090197863-A1 BENZOXAZOLE CARBOXAMIDE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) PARP1, PARP2, PARP11 DPP4 643/4885PKMYT1 2507/4885WEE1 1239/4885

“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.