SCHEMBL4248610

SCHEMBL4248610

O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)nc1)c1cccc(F)c1

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.83
CRACR2A Q9BSW2 1/20 0.53
TEK Q02763 1/20 0.49
BRAF P15056 1/20 0.48
CSF1R P07333 1/20 0.48
KCNQ3 O43525 1/20 0.48
KCNQ2 O43526 1/20 0.48
KCNE1 P15382 1/20 0.48
KCNQ1 P51787 1/20 0.48
NTRK1 P04629 1/20 0.48
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 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
SCHEMBL4249945 0.93 EPHX2 (0.83) EPHX2CRACR2ATEKNTRK1
SCHEMBL4250527 0.92 EPHX2 (0.84) EPHX2CRACR2ATEKBRAFCSF1R
SCHEMBL4245798 0.92 EPHX2 (0.91) EPHX2CRACR2ATEKBRAFCSF1R
SCHEMBL4246095 0.91 EPHX2 (0.83) EPHX2CRACR2ATEKBRAFCSF1R
SCHEMBL4248491 0.91 EPHX2 (1.00) EPHX2CRACR2ATEKRAB9A
SCHEMBL4248906 0.90 EPHX2 (0.82) EPHX2CRACR2ATEKBRAFCSF1R
SCHEMBL4250841 0.90 EPHX2 (0.82) EPHX2CRACR2ATEKALDH1A1
SCHEMBL4248369 0.90 EPHX2 (0.82) EPHX2CRACR2ATEKBRAFCSF1R
SCHEMBL4250539 0.90 EPHX2 (0.82) EPHX2CRACR2ATEKCSF1R
SCHEMBL4252693 0.90 EPHX2 (0.82) EPHX2CRACR2ATEK

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-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 US disclosed
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 US disclosed
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 US disclosed
WO-2007067836-A2 SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-14 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-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors EPHX1, EPHX2, EPX EPHX2 2/4885CRACR2A 3167/4885TEK 3345/4885

“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.