SCHEMBL13876229

SCHEMBL13876229

CS(=O)(=O)c1cc(F)ccc1CNC(=O)c1ccc(Oc2ncccn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.47
DDR1 Q08345 1/20 0.47
MAPK14 Q16539 2/20 0.47
CYP3A4 P08684 1/20 0.47
RAB9A P51151 3/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.43
DGAT2 Q96PD7 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NR1H4 Q96RI1 1/20 0.42

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
SCHEMBL13876231 0.90 DDR1 (0.52) EPHX2DDR1RAB9ANPC1SMN1; SMN2
SCHEMBL13876213 0.80 EPHX2 (0.56) EPHX2MAPK14RAB9ANPC1SMN1; SMN2
SCHEMBL13876232 0.79 DDR1 (0.63) EPHX2DDR1MAPK14MAPTNR1H4
SCHEMBL13876237 0.75 HPGDS (0.51) EPHX2DDR1DGAT2
SCHEMBL13876171 0.74 TSHR (0.61) EPHX2MAPK14CYP3A4LMNANR1H4
SCHEMBL13876241 0.72 EPHX2 (0.49) EPHX2DDR1MAPK14DGAT2NR1H4
SCHEMBL13876187 0.72 EPHX2 (0.58) EPHX2MAPK14
SCHEMBL13876233 0.72 ALDH1A1 (0.51) EPHX2DDR1RAB9ANPC1SMN1; SMN2
SCHEMBL13876240 0.72 EPHX2 (0.51) EPHX2DDR1NR1H4
SCHEMBL13876234 0.71 SCN10A (0.52) EPHX2DDR1NR1H4

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
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 2/4885DDR1 3354/4885MAPK14 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.