SCHEMBL12359233

SCHEMBL12359233

CN(C)Sc1ccccc1-c1ccc2[nH]c(CCc3ccc(C(F)(F)F)cc3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 5/20 0.57
▸ NTRK1 P04629 5/20 0.42
▸ NTRK2 Q16620 3/20 0.42
▸ PDE10A Q9Y233 3/20 0.40
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MCHR1 Q99705 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ OPRL1 P41146 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ QPCT Q16769 1/20 0.34

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
SCHEMBL2241782 0.81 TRPV1 (0.67) TRPV1NTRK1NTRK2PDE10ARAB9A
SCHEMBL2241285 0.80 TRPV1 (0.85) TRPV1NTRK1NTRK2PDE10ARAB9A
SCHEMBL1794101 0.80 TRPV1 (0.60) TRPV1NTRK1NTRK2PDE10ARAB9A
SCHEMBL2243168 0.78 TRPV1 (0.60) TRPV1NTRK1NTRK2
SCHEMBL2239628 0.78 TRPV1 (0.85) TRPV1NTRK1NTRK2PDE10ARAB9A
SCHEMBL1797790 0.77 TRPV1 (0.58) TRPV1NTRK1NTRK2RAB9ANPC1
SCHEMBL2240498 0.77 TRPV1 (0.67) TRPV1NTRK1NTRK2RAB9ANPC1
SCHEMBL1797610 0.76 TRPV1 (0.60) TRPV1NTRK1NTRK2PDE10ARAB9A
SCHEMBL12358874 0.76 TRPV1 (0.45) TRPV1NTRK1NTRK2PDE10ARAB9A
SCHEMBL12359234 0.75 RAB9A (0.53) TRPV1PDE10ARAB9ANPC1MAPT

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-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2011-08-04 — — 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-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 VRK1, VRK2, VIL1 TRPV1 29/4885NTRK1 2537/4885NTRK2 2593/4885

“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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