SCHEMBL4777438

SCHEMBL4777438

CN(C(=O)c1ccc(N(Cc2cccc(Cl)c2Cl)S(=O)(=O)N(CC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1)c1ccc(C(F)(F)F)nc1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 12/20 0.36
GPBAR1 Q8TDU6 5/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
OXTR P30559 1/20 0.31
REN P00797 1/20 0.31

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
SCHEMBL4777432 0.90 TRPM8 (0.37) TRPM8GPBAR1ALDH1A1GAAOXTR
SCHEMBL4777442 0.86 GAA (0.44) TRPM8GAA
SCHEMBL4771001 0.84 ALDH1A1 (0.36) TRPM8GPBAR1ALDH1A1GAAOXTR
SCHEMBL4777428 0.79 GAA (0.45) TRPM8GAA
SCHEMBL4767893 0.79 TRPM8 (0.37) TRPM8GPBAR1ALDH1A1GAAOXTR
SCHEMBL4777521 0.77 GPBAR1 (0.42) TRPM8GPBAR1ALDH1A1GAAOXTR
SCHEMBL4771084 0.77 GPBAR1 (0.37) TRPM8GPBAR1ALDH1A1GAAOXTR
SCHEMBL4776918 0.76 TRPM8 (0.41) TRPM8GPBAR1OXTR
SCHEMBL4777539 0.76 GPBAR1 (0.36) TRPM8GPBAR1ALDH1A1GAAOXTR
SCHEMBL4767615 0.76 NR1H3 (0.41) TRPM8GPBAR1ALDH1A1OXTR

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
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP claimed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US claimed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 WO claimed
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP disclosed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US disclosed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 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-20070135435-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 TRPM8 3499/4885GPBAR1 3732/4885ALDH1A1 2159/4885

“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.