SCHEMBL13876173

SCHEMBL13876173

O=C(NCc1ccc(Cl)cc1Cl)c1cccc(Oc2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.56
MAPK14 Q16539 2/20 0.55
LMNA P02545 2/20 0.53
EPHX2 P34913 4/20 0.52
DDR1 Q08345 2/20 0.51
NR1H4 Q96RI1 1/20 0.51
CCR2 P41597 2/20 0.51
MAPK1 P28482 1/20 0.50
NLRP1 Q9C000 1/20 0.50
TRPV1 Q8NER1 1/20 0.50
RAF1 P04049 3/20 0.49
ALOX5 P09917 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
SCHEMBL13876221 0.86 EPHX2 (0.56) TP53MAPK14EPHX2DDR1NR1H4
SCHEMBL13876172 0.80 TSHR (0.59) LMNAEPHX2MAPK1NLRP1ALOX5
SCHEMBL14456972 0.80 MEN1 (0.55) LMNATRPV1RAF1
SCHEMBL13876192 0.79 MAPK14 (0.57) TP53MAPK14LMNAEPHX2DDR1
SCHEMBL5645070 0.78 LMNA (0.64) TP53LMNAEPHX2MAPK1NLRP1
SCHEMBL13876232 0.77 DDR1 (0.63) MAPK14EPHX2DDR1NR1H4
SCHEMBL5646507 0.77 LMNA (0.70) LMNAEPHX2NR1H4MAPK1NLRP1
SCHEMBL13876171 0.75 TSHR (0.61) MAPK14LMNAEPHX2NR1H4MAPK1
SCHEMBL4614558 0.73 MAPK14 (0.64) MAPK14
SCHEMBL4614555 0.73 MAPK14 (0.64) MAPK14

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 TP53 3483/4885MAPK14 2991/4885LMNA 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.