SCHEMBL1686549

SCHEMBL1686549

Cc1c(C(=O)O)noc1-c1ccc(C(F)(F)F)c(F)c1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.59
KIF11 P52732 8/20 0.47
DUSP3 P51452 1/20 0.43
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
SMURF2 Q9HAU4 1/20 0.40
SMURF1 Q9HCE7 1/20 0.40
FFAR1 O14842 1/20 0.40
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39
P2RX7 Q99572 1/20 0.39

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
SCHEMBL2779934 0.90 TRPV1 (0.52) TRPV1KIF11DUSP3CYP11B1CYP11B2
SCHEMBL1686447 0.89 TRPV1 (0.61) TRPV1KIF11CYP11B1CYP11B2P2RX7
SCHEMBL1686401 0.85 TRPV1 (0.59) TRPV1KIF11DUSP3
SCHEMBL766496 0.84 TRPV1 (0.55) TRPV1KIF11CYP11B1CYP11B2P2RX7
SCHEMBL766679 0.82 TRPV1 (0.69) TRPV1KIF11DUSP3FFAR1RARA
SCHEMBL1686325 0.82 TRPV1 (0.76) TRPV1KIF11P2RX7
SCHEMBL1686553 0.82 TRPV1 (0.62) TRPV1KIF11CYP11B1CYP11B2P2RX7
SCHEMBL1686321 0.82 TRPV1 (0.76) TRPV1KIF11P2RX7
SCHEMBL1686303 0.80 TRPV1 (0.82) TRPV1
SCHEMBL18662474 0.80 TRPV1 (0.52) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211927-B2 5-phenyl-isoxazole-3-carboxamide derivatives as TRPV1 modulators MSD, Oss B.V. (NL) 2012-07-03 US disclosed
EP-2185530-B1 5-PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS ORGANON NV (NL) 2011-09-14 EP disclosed
US-20110065764-A1 5- PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS N.V. Organon and Pharmacopeia, LLC (NL) 2011-03-17 US disclosed
CN-101796036-A 5-Phenylisoxazole-3-carboxamide derivatives as TRPV1 modulators ORGANON NV 2010-08-04 CN disclosed
EP-2185530-A1 5-PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS N.V. Organon (NL) 2010-05-19 EP disclosed
WO-2009016241-A1 5-PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS N.V. ORGANON (NL) 2009-02-05 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-20110065764-A1 5- PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS TRPV1, TRPV5, TRPV3 TRPV1 1/4885KIF11 3495/4885DUSP3 2145/4885

“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.