SCHEMBL13876309

SCHEMBL13876309

N#Cc1ccc(CNC(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)nc2)c(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.63
NR1H4 Q96RI1 1/20 0.51
TRPV1 Q8NER1 2/20 0.48
SCN2A Q99250 2/20 0.47
SCN10A Q9Y5Y9 2/20 0.47
CHEK1 O14757 1/20 0.44
PRKAA2 P54646 1/20 0.44
EGLN1 Q9GZT9 2/20 0.43
GCGR P47871 1/20 0.43
PPARA Q07869 1/20 0.42
P2RX7 Q99572 1/20 0.41
HPGDS O60760 1/20 0.41

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
SCHEMBL13876494 0.88 EPHX2 (0.63) EPHX2NR1H4PRKAA2EGLN1P2RX7
SCHEMBL13876320 0.87 EPHX2 (0.61) EPHX2PRKAA2EGLN1P2RX7HPGDS
SCHEMBL13876337 0.87 EPHX2 (0.60) EPHX2SCN2ASCN10APRKAA2EGLN1
SCHEMBL13876519 0.83 EPHX2 (0.63) EPHX2NR1H4TRPV1SCN2ASCN10A
SCHEMBL13876779 0.82 EPHX2 (0.59) EPHX2PRKAA2EGLN1P2RX7HPGDS
SCHEMBL13876275 0.82 EPHX2 (0.64) EPHX2NR1H4TRPV1SCN2ASCN10A
SCHEMBL13876781 0.81 EPHX2 (0.54) EPHX2PRKAA2EGLN1P2RX7HPGDS
SCHEMBL13876316 0.81 EPHX2 (0.58) EPHX2PRKAA2EGLN1P2RX7HPGDS
SCHEMBL13876783 0.79 EPHX2 (0.52) EPHX2NR1H4TRPV1CHEK1P2RX7
SCHEMBL4194766 0.79 EPHX2 (0.82) EPHX2TRPV1P2RX7

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
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 142/4885TRPV1 2999/4885

“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.