SCHEMBL13876367

SCHEMBL13876367

CC(C)CCNC(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 2/20 0.51
EPHX2 P34913 3/20 0.50
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
CYP2J2 P51589 1/20 0.48
LMNA P02545 1/20 0.48
GRM5 P41594 1/20 0.47
OPRM1 P35372 2/20 0.46
OPRD1 P41143 2/20 0.46
OPRK1 P41145 1/20 0.46
GRN P28799 2/20 0.46
SORT1 Q99523 2/20 0.46
PPARD Q03181 2/20 0.46
TRPV1 Q8NER1 3/20 0.45
SCD O00767 1/20 0.44
HPGDS O60760 1/20 0.43

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
SCHEMBL13876371 0.90 LIPE (0.54) LIPEEPHX2CYP2C9CYP2C19CYP2J2
SCHEMBL14457026 0.86 GRM5 (0.50) LIPEEPHX2CYP2C9CYP2C19CYP2J2
SCHEMBL13876984 0.86 TRPV1 (0.55) EPHX2TRPV1
SCHEMBL13876376 0.86 EPHX2 (0.54) EPHX2CYP2C9CYP2C19CYP2J2LMNA
SCHEMBL13876388 0.85 GCGR (0.52) EPHX2GRM5PPARDTRPV1SCD
SCHEMBL13876815 0.84 EPHX2 (0.49) EPHX2LMNATRPV1
SCHEMBL14456723 0.83 GRM5 (0.50) LIPEEPHX2CYP2C9CYP2C19CYP2J2
SCHEMBL13876381 0.83 GRM5 (0.52) EPHX2GRM5OPRM1OPRD1OPRK1
SCHEMBL13876362 0.83 EPHX2 (0.55) EPHX2GRM5OPRM1OPRD1OPRK1
SCHEMBL4178518 0.81 EPHX2 (0.73) EPHX2CYP2C9CYP2C19CYP2J2GRM5

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 LIPE 634/4885EPHX2 2/4885CYP2C9 274/4885

“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.