SCHEMBL4199381

SCHEMBL4199381

O=C(NCc1ccc(Cl)cc1Cl)c1ccn(CC2CC2)c(=O)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.53
EPHX2 P34913 5/20 0.50
LMNA P02545 2/20 0.49
MAPK1 P28482 1/20 0.49
NLRP1 Q9C000 1/20 0.49
MAPK8 P45983 2/20 0.48

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
SCHEMBL4190539 0.86 EPHX2 (0.63) P2RX7EPHX2LMNAMAPK1NLRP1
SCHEMBL4185601 0.84 LMNA (0.59) P2RX7EPHX2LMNAMAPK1NLRP1
SCHEMBL4188570 0.79 MAPK8 (0.59) P2RX7EPHX2LMNAMAPK1NLRP1
SCHEMBL4197581 0.78 EPHX2 (0.76) P2RX7EPHX2LMNAMAPK1NLRP1
SCHEMBL4189333 0.76 LMNA (0.53) EPHX2LMNAMAPK1NLRP1MAPK8
SCHEMBL14457433 0.73 P2RX7 (0.54) P2RX7
SCHEMBL5645070 0.72 LMNA (0.64) EPHX2LMNAMAPK1NLRP1
SCHEMBL4652001 0.72 EPHX2 (0.61) P2RX7EPHX2LMNAMAPK1NLRP1
SCHEMBL13522290 0.71 PI4KA (0.42)
SCHEMBL4189507 0.71 EPHX2 (0.74) P2RX7EPHX2LMNAMAPK1NLRP1

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 P2RX7 1271/4885EPHX2 2/4885LMNA 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.