SCHEMBL4590986

SCHEMBL4590986

CCCCc1ccc(NC(=O)c2ccc(-c3ncccc3Cl)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 16/20 0.67
▸ TRPV4 Q9HBA0 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ NPC1 O15118 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL3874198 0.89 TRPV1 (0.73) TRPV1TRPV4NPC1RAB9ASMN1; SMN2
SCHEMBL14083932 0.88 NPC1 (0.57) TRPV1NPC1ALDH1A1NFKB1RAB9A
SCHEMBL14083133 0.85 TRPV1 (0.61) TRPV1KDM4ENPC1RAB9A
SCHEMBL14084061 0.84 TRPV1 (0.72) TRPV1
SCHEMBL14083359 0.84 TRPV1 (0.52) TRPV1NPC1ALDH1A1NFKB1RAB9A
SCHEMBL14083605 0.84 TRPV1 (0.53) TRPV1NPC1ALDH1A1NFKB1RAB9A
SCHEMBL14083653 0.84 TRPV1 (0.50) TRPV1KDM4ENPC1ALDH1A1NFKB1
SCHEMBL14083746 0.83 TRPV1 (0.49) TRPV1KDM4ENPC1ALDH1A1NFKB1
SCHEMBL14083216 0.83 KDR (0.49) TRPV1NPC1ALDH1A1NFKB1RAB9A
SCHEMBL4811455 0.83 TRPV1 (0.65) TRPV1TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664041-B1 PHENYL-CARBOXAMIDE COMPOUNDS USEFUL FOR TREATING PAIN EURO CELTIQUE SA (LU) 2008-07-02 — — EP claimed
EP-1575918-A2 SUBSTITUTED BIARYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2005-09-21 — — EP claimed
WO-2004056774-A2 SUBSTITUTED BIPHENYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2004-07-08 — — WO claimed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues NEUROGEN CORPORATION (US) 2006-05-11 — — 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 (2 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 TRPV1 1/4885TRPV4 6/4885KDM4E 4231/4885
US-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues HCAR2, AHR, HCAR3 TRPV1 53/4885TRPV4 154/4885KDM4E 2121/4885

“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.

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