SCHEMBL4590059

SCHEMBL4590059

CCC(C)c1ccc(NC(=O)c2ccc(-c3ncccc3F)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 18/20 0.67
NPC1 O15118 1/20 0.58
ALDH1A1 P00352 1/20 0.58
TP53 P04637 1/20 0.58
RAB9A P51151 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL4591175 0.89 TRPV1 (0.77) TRPV1NPC1TP53RAB9ASMN1; SMN2
SCHEMBL14083896 0.87 TRPV1 (0.67) TRPV1NPC1ALDH1A1TP53RAB9A
SCHEMBL14084078 0.86 TRPV1 (0.72) TRPV1NPC1ALDH1A1TP53RAB9A
SCHEMBL14083148 0.85 TRPV1 (0.59) TRPV1NPC1ALDH1A1TP53RAB9A
SCHEMBL15779636 0.83 TRPV1 (0.78) TRPV1NPC1RAB9A
SCHEMBL5934454 0.82 TRPV1 (0.77) TRPV1
SCHEMBL14083425 0.82 TRPV1 (0.70) TRPV1NPC1ALDH1A1TP53RAB9A
SCHEMBL4812658 0.81 TRPV1 (0.69) TRPV1
SCHEMBL3873424 0.81 TRPV1 (1.00) TRPV1
SCHEMBL10324366 0.81 TRPV1 (0.74) 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 4 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-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 (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-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues HCAR2, AHR, HCAR3 TRPV1 53/4885NPC1 3100/4885ALDH1A1 325/4885

“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.