SCHEMBL1065657

SCHEMBL1065657

CCC(CCN(C)C)NC(N)=O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP8 P22894 1/20 0.34
CA9 Q16790 1/20 0.34
TAS1R3 Q7RTX0 3/20 0.34
TAS1R1 Q7RTX1 3/20 0.34
UTS2R Q9UKP6 13/20 0.33
HTT P42858 1/20 0.33
CAD P27708 1/20 0.32

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
SCHEMBL11262354 0.82 UTS2R (0.36) CA12CA1CA2MMP1MMP2
SCHEMBL18390896 0.81 ALDH1A1 (0.38) CA12CA1CA2MMP1MMP2
SCHEMBL292771 0.79 TAS1R3 (0.49) CA12CA1CA2MMP1MMP2
SCHEMBL13895348 0.79 CA12 (0.33) CA12CA1CA2MMP1MMP2
SCHEMBL25099130 0.79 CNR2 (0.38) CA12CA1CA2MMP1MMP2
SCHEMBL292567 0.79
SCHEMBL18390895 0.78 ALDH1A1 (0.43) CA12CA1CA2MMP1MMP2
SCHEMBL2672239 0.76 ANPEP (0.34) UTS2RCAD
SCHEMBL8158509 0.76 PRMT3 (0.36) UTS2R
SCHEMBL7916905 0.74 CA1 (0.44) CA1CA2TAS1R3TAS1R1

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 9 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-8455652-B2 Inhibitors for the soluble epoxide hydrolase THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-06-04 US disclosed
US-8192646-B2 Inorganic particle conjugates MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-06-05 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-20090326039-A1 INHIBITORS FOR THE SOLUBLE EPOXIDE HYDROLASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-12-31 US disclosed
US-20060270609-A1 Inhibitors for the soluble epoxide hydrolase REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-11-30 US disclosed
US-20050164951-A1 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-07-28 US disclosed
US-20050026844-A1 Inhibitors for the soluble epoxide hydrolase REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-02-03 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 (5 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-20090326039-A1 INHIBITORS FOR THE SOLUBLE EPOXIDE HYDROLASE EPHX1, EPHX2, NCEH1 CA12 3012/4885CA1 2341/4885CA2 3657/4885
US-20050164951-A1 Inhibitors for the soluble epoxide hydrolase EPHX1, EPHX2, NCEH1 CA12 3012/4885CA1 2341/4885CA2 3657/4885
US-20060270609-A1 Inhibitors for the soluble epoxide hydrolase EPHX1, EPHX2, NCEH1 CA12 3012/4885CA1 2341/4885CA2 3657/4885
US-20110021448-A1 Inhibitors for the Soluble Epoxide Hydrolase EPHX1, EPHX2, NCEH1 CA12 3012/4885CA1 2341/4885CA2 3657/4885
US-20050026844-A1 Inhibitors for the soluble epoxide hydrolase EPHX1, EPHX2, NCEH1 CA12 3012/4885CA1 2341/4885CA2 3657/4885

“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.