SCHEMBL13876248

SCHEMBL13876248

CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(Oc3ccc(S(C)(=O)=O)cc3)nc2)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 17/20 0.68
NR1H4 Q96RI1 3/20 0.46
RORC P51449 1/20 0.45
OPRM1 P35372 2/20 0.42
OPRD1 P41143 2/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL13876829 0.95 EPHX2 (0.71) EPHX2NR1H4OPRM1OPRD1OPRK1
SCHEMBL13876535 0.93 EPHX2 (0.70) EPHX2NR1H4RORCOPRM1OPRD1
SCHEMBL13890755 0.93 EPHX2 (0.68) EPHX2NR1H4OPRM1OPRD1OPRK1
SCHEMBL13876247 0.91 EPHX2 (0.64) EPHX2NR1H4RORC
SCHEMBL14456746 0.90 EPHX2 (0.64) EPHX2NR1H4RORCOPRM1OPRD1
SCHEMBL4192539 0.90 EPHX2 (0.63) EPHX2NR1H4RORC
SCHEMBL13876249 0.90 EPHX2 (0.72) EPHX2NR1H4
SCHEMBL13876256 0.90 EPHX2 (0.64) EPHX2NR1H4RORCOPRM1OPRD1
SCHEMBL4191984 0.88 EPHX2 (0.69) EPHX2NR1H4RORC
SCHEMBL14456747 0.86 EPHX2 (0.64) EPHX2NR1H4OPRM1OPRD1OPRK1

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 2 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

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 142/4885RORC 1229/4885

“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.