SCHEMBL4189504

SCHEMBL4189504

CS(=O)(=O)c1ccc(-c2ccc(CNC(=O)c3ccc(OCC(F)(F)F)nc3)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.82
NR1H4 Q96RI1 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.49
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
CYP2J2 P51589 1/20 0.48
DGAT1 O75907 1/20 0.46
RORC P51449 1/20 0.46
KCNH2 Q12809 1/20 0.45
SCN5A Q14524 1/20 0.45
SCN9A Q15858 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL13876156 0.97 EPHX2 (0.81) EPHX2NR1H4L3MBTL1CYP2C9CYP2C19
SCHEMBL13876484 0.84 EPHX2 (0.69) EPHX2NR1H4CYP2C9CYP2C19
SCHEMBL13876475 0.83 EPHX2 (0.68) EPHX2NR1H4RORCCA1CA2
SCHEMBL4188251 0.81 EPHX2 (0.83) EPHX2NR1H4L3MBTL1
SCHEMBL14456994 0.81 EPHX2 (0.66) EPHX2NR1H4RORCCA1CA2
SCHEMBL13876481 0.81 EPHX2 (0.65) EPHX2NR1H4
SCHEMBL13876485 0.79 EPHX2 (0.64) EPHX2NR1H4L3MBTL1RORCCA1
SCHEMBL13876489 0.79 EPHX2 (0.64) EPHX2NR1H4CYP2C9RORCCA1
SCHEMBL4181196 0.78 EPHX2 (0.81) EPHX2L3MBTL1CYP2C9CYP2C19CYP2J2
SCHEMBL12640604 0.77 EPHX2 (0.55) EPHX2L3MBTL1CYP2C9CYP2C19CYP2J2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-16 US disclosed
US-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-16 US disclosed
US-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-16 US disclosed
WO-2007098352-A2 SUBSTITUTED PYRIDINEAMIDE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-30 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-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors EPHX1, EPHX2, NCEH1 EPHX2 2/4885NR1H4 142/4885L3MBTL1 4642/4885

“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.