SCHEMBL13873773

SCHEMBL13873773

C[C@H](CNC(=O)N1CCC(Oc2cnccn2)CC1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 6/20 0.62
▸ CYP2C9 P11712 3/20 0.62
▸ NAAA Q02083 2/20 0.45
▸ NAMPT P43490 2/20 0.42
▸ PRMT5 O14744 5/20 0.42
▸ WDR77 Q9BQA1 1/20 0.42
▸ P2RX7 Q99572 1/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.40
▸ CYP2J2 P51589 1/20 0.40
▸ ACACB O00763 1/20 0.40

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
SCHEMBL13873765 0.85 EPHX2 (0.55) EPHX2CYP2C9PRMT5WDR77TAAR1
SCHEMBL13873793 0.84 EPHX2 (0.57) EPHX2CYP2C9NAMPTPRMT5WDR77
SCHEMBL13873586 0.81 EPHX2 (0.66) EPHX2CYP2C9NAAANAMPT
SCHEMBL13873835 0.79 EPHX2 (0.63) EPHX2CYP2C9NAMPTPRMT5WDR77
SCHEMBL13873594 0.78 EPHX2 (0.58) EPHX2CYP2C9CYP2J2
SCHEMBL13873827 0.78 EPHX2 (0.53) EPHX2CYP2C9NAMPTPRMT5WDR77
SCHEMBL13873589 0.77 EPHX2 (0.61) EPHX2CYP2C9NAAANAMPTCYP2J2
SCHEMBL13873774 0.77 EPHX2 (1.00) EPHX2CYP2C9P2RX7CYP2J2ACACB
SCHEMBL13873587 0.76 EPHX2 (0.62) EPHX2CYP2C9NAAANAMPT
SCHEMBL13873862 0.76 MEN1 (0.54) PRMT5WDR77

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 EPHX2 2/4885CYP2C9 477/4885NAAA 418/4885

“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