SCHEMBL4197019

SCHEMBL4197019

N#Cc1ccccc1Oc1cc(C(=O)NCc2ccc(Cl)cc2Cl)ccn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.51
TSHR P16473 1/20 0.51
MAPK14 Q16539 4/20 0.47
CYP3A4 P08684 1/20 0.47
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.43
NLRP1 Q9C000 1/20 0.43
F10 P00742 2/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
ALOX5 P09917 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
SCHEMBL4185976 0.87 EPHX2 (0.60) EPHX2TSHRMAPK14CYP3A4LMNA
SCHEMBL4199501 0.83 TSHR (0.64) EPHX2TSHRLMNAMAPK1NLRP1
SCHEMBL4192517 0.83 EPHX2 (0.50) EPHX2TSHRLMNAMAPK1NLRP1
SCHEMBL4187148 0.82 EPHX2 (0.52) EPHX2TSHRLMNAMAPK1NLRP1
SCHEMBL4180231 0.82 EPHX2 (0.52) EPHX2TSHRLMNAMAPK1NLRP1
SCHEMBL13876784 0.80 EPHX2 (0.55) EPHX2TSHRALDH1A1ROCK2ROCK1
SCHEMBL4192919 0.79 EPHX2 (0.52) EPHX2TSHRMAPK14CYP3A4LMNA
SCHEMBL4178412 0.79 TSHR (0.52) EPHX2TSHRMAPK14CYP3A4LMNA
SCHEMBL13876786 0.79 EPHX2 (0.47) EPHX2TSHRALDH1A1ROCK2
SCHEMBL4194897 0.78 LMNA (0.56) EPHX2TSHRLMNAMAPK1NLRP1

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 2/4885TSHR 4438/4885MAPK14 2991/4885

“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.