SCHEMBL7679476

SCHEMBL7679476

O=C(N[C@@H](c1ccccc1)c1ccccn1)c1cnc2cc(NC(=O)c3cccnc3-c3ccc(C(F)(F)F)cc3)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.43
TRPM8 Q7Z2W7 5/20 0.43
S1PR2 O95136 1/20 0.41
S1PR4 O95977 1/20 0.41
S1PR3 Q99500 1/20 0.41

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
SCHEMBL7920131 0.92 MTTP (0.48) TRPV1
SCHEMBL6769816 0.89 TRPV1 (0.46) TRPV1
SCHEMBL6775259 0.87 TRPV1 (0.44) TRPV1
SCHEMBL6766297 0.87 MTTP (0.47) TRPV1TRPM8
SCHEMBL6769200 0.87 MTTP (0.47) TRPV1TRPM8
SCHEMBL6769957 0.86 TRPV1 (0.41) TRPV1TRPM8S1PR2S1PR4S1PR3
SCHEMBL6765865 0.84 TRPV1 (0.53) TRPV1
SCHEMBL6053015 0.84 MTTP (0.52)
SCHEMBL6766033 0.82 ADORA2A (0.46) TRPV1
SCHEMBL6770046 0.80 ADORA2A (0.47) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020132806-A1 7-[(4'-trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B RUGGERI ROGER (US) 2002-09-19 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-20020132806-A1 7-[(4'-trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B APOB, CETP, PNLIP TRPV1 3593/4885TRPM8 3981/4885S1PR2 4035/4885

“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.