SCHEMBL12931990

SCHEMBL12931990

COc1ccc(NC(=O)CC2CCCCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 1.00
RAB9A P51151 4/20 0.66
NPC1 O15118 3/20 0.66
KMT2A Q03164 2/20 0.66
NAMPT P43490 1/20 0.65
ALDH1A1 P00352 2/20 0.65
KLK7 P49862 1/20 0.63
EPHX1 P07099 1/20 0.59
MAPT P10636 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
GPR183 P32249 1/20 0.56
MEN1 O00255 1/20 0.56
ALOX15 P16050 1/20 0.56
LMNA P02545 1/20 0.55

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
SCHEMBL17737372 0.85 EPHX2 (0.73) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL17737051 0.85 EPHX2 (0.73) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL20838672 0.85 EPHX2 (0.73) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL23680252 0.83 RAB9A (0.71) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL5648192 0.83 EPHX2 (0.71) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL15376425 0.82 EPHX2 (0.70) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL11520494 0.81 RAB9A (0.97) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL5647839 0.81 EPHX2 (0.73) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL17318325 0.81 IDO1 (0.71) EPHX2RAB9ANPC1KMT2ANAMPT
SCHEMBL17730903 0.81 IDO1 (0.71) EPHX2RAB9ANPC1KMT2ANAMPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476043-B2 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-07-02 US disclosed
US-8476043-B2 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-07-02 US disclosed
US-20110021448-A1 Inhibitors for the Soluble Epoxide Hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-01-27 US disclosed
US-20110021448-A1 Inhibitors for the Soluble Epoxide Hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-01-27 US disclosed
US-7662910-B2 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-02-16 US disclosed
US-7662910-B2 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-02-16 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-20110021448-A1 Inhibitors for the Soluble Epoxide Hydrolase EPHX1, EPHX2, NCEH1 EPHX2 2/4885RAB9A 3525/4885NPC1 778/4885

“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.