SCHEMBL15624826

SCHEMBL15624826

COc1ccc(NC(=O)N[C@H]2CC[C@@H](Oc3ccc(C(=O)O)cc3)CC2)cc1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 19/20 0.80
▸ FAAH O00519 7/20 0.80
▸ RAF1 P04049 2/20 0.63
▸ NPC1 O15118 1/20 0.63
▸ RAB9A P51151 1/20 0.63
▸ EPHX1 P07099 1/20 0.63

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
SCHEMBL15624864 1.00 EPHX2 (0.80) EPHX2FAAHRAF1NPC1RAB9A
SCHEMBL15624859 0.91 EPHX2 (0.72) EPHX2FAAHRAF1NPC1RAB9A
SCHEMBL15624868 0.91 EPHX2 (0.80) EPHX2FAAHRAF1
SCHEMBL15624850 0.91 EPHX2 (0.80) EPHX2FAAHRAF1
SCHEMBL17428305 0.91 EPHX2 (0.80) EPHX2FAAHRAF1
SCHEMBL19381962 0.89 EPHX2 (1.00) EPHX2FAAHRAF1
SCHEMBL19381584 0.89 EPHX2 (1.00) EPHX2FAAHRAF1
SCHEMBL15624829 0.88 EPHX2 (0.77) EPHX2FAAHRAF1NPC1RAB9A
SCHEMBL20390673 0.88 EPHX2 (0.77) EPHX2FAAHRAF1NPC1RAB9A
SCHEMBL15612095 0.88 EPHX2 (1.00) EPHX2FAAHRAF1

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-9029401-B2 Sorafenib derivatives as sEH inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-05-12 — — US disclosed
US-20140088156-A1 SORAFENIB DERIVATIVES AS SEH INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-03-27 — — 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-20140088156-A1 SORAFENIB DERIVATIVES AS SEH INHIBITORS EPHX1, FAH, EPHX2 EPHX2 3/4885FAAH 84/4885RAF1 55/4885

“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.

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