SCHEMBL265243

SCHEMBL265243

CCC(NC(=O)c1ccc2nc(C(C)(C)C(F)(F)F)ccc2c1)c1ccnc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.39
PPARG P37231 3/20 0.38
TACR3 P29371 8/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TACR2 P21452 3/20 0.36
KLKB1 P03952 1/20 0.36
PLK1 P53350 1/20 0.35

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
SCHEMBL263915 0.93 TRPM8 (0.39) TRPM8PPARGTACR3TAS1R3TAS1R1
SCHEMBL263527 0.88 TAS1R3 (0.37) TRPM8PPARGTAS1R3TAS1R1KLKB1
SCHEMBL262685 0.88 PPARG (0.46) TRPM8PPARGTAS1R3TAS1R1PLK1
SCHEMBL264363 0.88 PPARG (0.46) TRPM8PPARGTAS1R3TAS1R1PLK1
SCHEMBL264373 0.81 PPARG (0.46) TRPM8PPARGTAS1R3TAS1R1PLK1
SCHEMBL263858 0.81 SMN1; SMN2 (0.43)
SCHEMBL2011432 0.78 BRPF1 (0.43) PPARG
SCHEMBL1844261 0.78 BRPF1 (0.43) PPARG
SCHEMBL264812 0.72 TRPV1 (0.39) KLKB1PLK1
SCHEMBL263771 0.72 EGLN1 (0.40) KLKB1

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-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 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-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS OPRL1, CNR1, TRPV1 TRPM8 81/4885PPARG 771/4885TACR3 462/4885

“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.