SCHEMBL13873705

SCHEMBL13873705

O=C(NCc1ccc(C(F)(F)F)nc1)N1CCC(S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 17/20 0.52
▸ CYP2C9 P11712 3/20 0.48
▸ EPHX2 P34913 1/20 0.48
▸ SCN5A Q14524 1/20 0.46
▸ SCN9A Q15858 1/20 0.46
▸ KIT P10721 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
SCHEMBL13873726 0.94 NAMPT (0.51) NAMPTCYP2C9SCN5ASCN9A
SCHEMBL13873755 0.78 EPHX2 (0.57) NAMPTCYP2C9EPHX2SCN5ASCN9A
SCHEMBL13873512 0.78 HRH3 (0.63) NAMPT
SCHEMBL13873763 0.78 EPHX2 (0.61) NAMPTCYP2C9EPHX2SCN5ASCN9A
SCHEMBL13874900 0.78 EPHX2 (0.52) NAMPTCYP2C9EPHX2SCN5ASCN9A
SCHEMBL13873874 0.78 EPHX2 (0.63) NAMPTEPHX2SCN5ASCN9AKIT
SCHEMBL13873701 0.77 CHRM4 (0.50) NAMPTEPHX2SCN9AKIT
SCHEMBL13873859 0.77 MEN1 (0.54) NAMPTCYP2C9KIT
SCHEMBL13873825 0.75 EPHX2 (0.55) CYP2C9EPHX2KIT
SCHEMBL13873789 0.75 EPHX2 (0.59) NAMPTCYP2C9EPHX2KIT

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-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 — — US disclosed
US-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 — — US disclosed
WO-2007106705-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-09-20 — — 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-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same EPHX1, EPHX2, NCEH1 NAMPT 1984/4885CYP2C9 477/4885EPHX2 2/4885

“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.

Send feedback