SCHEMBL17664488

SCHEMBL17664488

CCS(=O)(=O)c1cc(C(F)(F)F)ccc1-c1ncnc(OC)c1C

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 6/20 0.39
SCN9A Q15858 8/20 0.38
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
CRHR1 P34998 2/20 0.38
DDR1 Q08345 2/20 0.36
SCN1A P35498 1/20 0.36
SCN4A P35499 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
SCN8A Q9UQD0 1/20 0.36

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
SCHEMBL19501588 0.89 PTGDR2 (0.37) PTGDR2SCN9AALOX5APFEN1DDR1
SCHEMBL17664482 0.87 PTGDR2 (0.36) PTGDR2SCN9AALOX5APFEN1DDR1
SCHEMBL19501589 0.84 PTGDR2 (0.36) PTGDR2SCN9AALOX5APFEN1DDR1
SCHEMBL19501585 0.84 PTGDR2 (0.39) PTGDR2SCN9AALOX5APFEN1DDR1
SCHEMBL17664455 0.84 PTGDR2 (0.34) PTGDR2SCN9AALOX5APFEN1DDR1
SCHEMBL17664479 0.79 ALOX5AP (0.40) SCN9AALOX5APFEN1CRHR1
SCHEMBL17664494 0.78 CRHR1 (0.39) PTGDR2SCN9ACRHR1DDR1SCN1A
SCHEMBL19522228 0.77 DDR1 (0.34) PTGDR2DDR1
SCHEMBL17664477 0.77 SCN9A (0.41) PTGDR2SCN9AALOX5APFEN1DDR1
SCHEMBL17664480 0.76 PARP1 (0.43) PTGDR2ALOX5APFEN1DDR1

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
EP-3202762-B1 PYRIMIDINONE COMPOUND SUMITOMO CHEMICAL CO (JP) 2019-06-19 EP disclosed
US-9802930-B1 Pyrimidinone compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-31 US disclosed
US-20170305896-A1 PYRIMIDINONE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-26 US disclosed
EP-3202762-A1 PYRIMIDINONE COMPOUND Sumitomo Chemical Company, Limited (JP) 2017-08-09 EP disclosed
WO-2017090654-A1 PEST CONTROL COMPOSITION AND USE THEREOF 住友化学株式会社 2017-06-01 WO disclosed
WO-2016052247-A1 PYRIMIDINONE COMPOUND 住友化学株式会社 2016-04-07 WO 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-20170305896-A1 PYRIMIDINONE COMPOUND C5, C3AR1, CCR3 PTGDR2 1449/4885SCN9A 2811/4885ALOX5AP 4279/4885

“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.