SCHEMBL4909563

SCHEMBL4909563

CCc1cnc(N(CCNS(=O)(=O)c2cccc3c2CC(C(=O)O)C3)Cc2ccc(OC(F)(F)F)cc2)nc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.49
TRPM8 Q7Z2W7 16/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
CNR2 P34972 1/20 0.33

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
SCHEMBL4918849 0.93 PPARD (0.41) PPARDTRPM8PTGDR2
SCHEMBL4916372 0.85 PPARD (0.51) PPARDCNR2
SCHEMBL4919169 0.83 PPARD (0.49) PPARD
SCHEMBL4917186 0.83 PPARD (0.49) PPARD
SCHEMBL4913994 0.76 PPARD (0.41) PPARDPTGDR2
SCHEMBL4917309 0.74 TRPM8 (0.41) TRPM8PTGDR2CNR2
SCHEMBL4916382 0.74 PPARD (0.54) PPARDTRPM8CNR2
SCHEMBL14006364 0.74 OPRK1 (0.41) PPARDCNR2
SCHEMBL14006355 0.73 CKS1B (0.39) TRPM8
SCHEMBL4919179 0.72 PPARD (0.51) PPARDTRPM8CNR2

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-20080287477-A1 Novel Compounds as Modulators of Ppar KALYPSYS, INC. (US) 2008-11-20 US disclosed
US-20080287477-A1 Novel Compounds as Modulators of Ppar KALYPSYS, INC. (US) 2008-11-20 US disclosed
US-20080287477-A1 Novel Compounds as Modulators of Ppar KALYPSYS, INC. (US) 2008-11-20 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-20080287477-A1 Novel Compounds as Modulators of Ppar PPARG, PPARA, PPARD PPARD 3/4885TRPM8 1071/4885PTGDR2 122/4885

“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.