SCHEMBL12359288

SCHEMBL12359288

NSc1ccccc1-c1ccc2[nH]c(/C=C/c3ccc(Br)cc3)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 15/20 0.46
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ PKM P14618 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ MAPT P10636 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ TUBB4A P04350 1/20 0.41
▸ TUBB P07437 1/20 0.41
▸ TUBA3C P0DPH7 1/20 0.41

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
SCHEMBL12359235 0.91 TRPV1 (0.54) TRPV1NPC1RAB9AKMT2AKDM4E
SCHEMBL12358823 0.89 TRPV1 (0.44) TRPV1NPC1RAB9AKMT2AKDM4E
SCHEMBL12653103 0.89 MEN1 (0.57) TRPV1NPC1RAB9AKMT2AKDM4E
SCHEMBL12359282 0.86 TRPV1 (0.55) TRPV1NPC1RAB9AKMT2AKDM4E
SCHEMBL1800284 0.81 TRPV1 (0.70) TRPV1NPC1RAB9AKMT2ARXFP1
SCHEMBL1800281 0.81 TRPV1 (0.70) TRPV1NPC1RAB9AKMT2ARXFP1
SCHEMBL12359287 0.80 NPC1 (0.48) TRPV1NPC1RAB9AKMT2AKDM4E
SCHEMBL1795497 0.79 TRPV1 (0.71) TRPV1NPC1RAB9AKMT2ARXFP1
SCHEMBL1795494 0.79 TRPV1 (0.71) TRPV1NPC1RAB9AKMT2ARXFP1
SCHEMBL12359286 0.78 TRPV1 (0.60) TRPV1RAB9A

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 29/4885NPC1 750/4885RAB9A 3985/4885

“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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