SCHEMBL4193085

SCHEMBL4193085

O=C(NCc1ccc(Cl)cc1Cl)c1ccc(Oc2ccncc2)nc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.66
ROCK2 O75116 2/20 0.52
LMNA P02545 2/20 0.51
MAPK1 P28482 1/20 0.51
NLRP1 Q9C000 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK14 Q16539 1/20 0.51
TSHR P16473 1/20 0.51
CASP1 P29466 1/20 0.49
CYP2C9 P11712 1/20 0.48
CYP2J2 P51589 1/20 0.48
ROCK1 Q13464 1/20 0.46

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
SCHEMBL4190293 0.89 EPHX2 (0.63) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4185352 0.88 EPHX2 (0.68) EPHX2LMNAMAPK1NLRP1TSHR
SCHEMBL4178412 0.86 TSHR (0.52) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4193143 0.86 EPHX2 (0.62) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4188523 0.85 EPHX2 (0.66) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4192539 0.85 EPHX2 (0.63) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4197060 0.83 EPHX2 (0.72) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4187168 0.82 EPHX2 (0.74) EPHX2ROCK2LMNAMAPK1NLRP1
SCHEMBL4197131 0.81 EPHX2 (0.60) EPHX2LMNAMAPK1NLRP1TSHR
SCHEMBL4185742 0.81 EPHX2 (0.60) EPHX2ROCK2LMNAMAPK1NLRP1

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
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 2/4885ROCK2 2468/4885LMNA 2116/4885

“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.