SCHEMBL4248491

SCHEMBL4248491

O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)nc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 1.00
CRACR2A Q9BSW2 2/20 0.56
TEK Q02763 2/20 0.49
NAMPT P43490 3/20 0.48
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
ABL1 P00519 2/20 0.47
PDGFRB P09619 2/20 0.47
BCR P11274 2/20 0.47
PDGFRA P16234 2/20 0.47
PRKCA P17252 2/20 0.47
EGFR P00533 1/20 0.47
PRKD3 O94806 1/20 0.47
PRKCG P05129 1/20 0.47
PRKCB P05771 1/20 0.47
SRC P12931 1/20 0.47
PRKCH P24723 1/20 0.47
PRKCI P41743 1/20 0.47

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
SCHEMBL4245798 0.95 EPHX2 (0.91) EPHX2CRACR2ATEKLMNA
SCHEMBL4257269 0.94 EPHX2 (0.89) EPHX2CRACR2ATEKNPC1RAB9A
SCHEMBL4250527 0.92 EPHX2 (0.84) EPHX2CRACR2ATEKABL1BCR
SCHEMBL4249339 0.92 EPHX2 (0.84) EPHX2CRACR2ANAMPTLMNAABL1
SCHEMBL4248610 0.91 EPHX2 (0.83) EPHX2CRACR2ATEKRAB9A
SCHEMBL4246095 0.91 EPHX2 (0.83) EPHX2CRACR2ATEKABL1BCR
SCHEMBL4249945 0.91 EPHX2 (0.83) EPHX2CRACR2ATEKABL1PDGFRB
SCHEMBL4252829 0.91 EPHX2 (0.82) EPHX2CRACR2ATEKGAA
SCHEMBL4248906 0.90 EPHX2 (0.82) EPHX2CRACR2ATEKABL1BCR
SCHEMBL4250539 0.90 EPHX2 (0.82) EPHX2CRACR2ATEKLMNA

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.