SCHEMBL14084051

SCHEMBL14084051

COc1cccc(NC(=O)c2ccc(-c3ncccc3C(F)(F)F)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 12/20 0.67
▸ NPC1 O15118 3/20 0.59
▸ RAB9A P51151 3/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ TP53 P04637 1/20 0.58
▸ PKM P14618 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ GRM4 Q14833 1/20 0.57
▸ NLRP3 Q96P20 1/20 0.55
▸ TSHR P16473 1/20 0.55

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
SCHEMBL14084063 0.88 TRPV1 (0.70) TRPV1
SCHEMBL14083066 0.87 TRPV1 (0.58) TRPV1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14084086 0.86 TRPV1 (0.57) TRPV1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14083427 0.86 TRPV1 (0.63) TRPV1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14083122 0.86 TRPV1 (0.66) TRPV1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14084080 0.85 TRPV1 (0.70) TRPV1
SCHEMBL14083245 0.85 RAB9A (0.58) TRPV1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14084075 0.85 TRPV1 (0.79) TRPV1
SCHEMBL6364431 0.84 TRPV1 (0.80) TRPV1
SCHEMBL14083465 0.84 TRPV1 (0.63) TRPV1NPC1RAB9ASMN1; SMN2ALDH1A1

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
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

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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 TRPV1 1/4885NPC1 1061/4885RAB9A 1914/4885

“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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