SCHEMBL12359287

SCHEMBL12359287

NSc1ccccc1-c1ccc2[nH]c(/C=C/c3ccccc3Cl)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ GAA P10253 3/20 0.48
▸ MAPT P10636 3/20 0.48
▸ HPGD P15428 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ GLA P06280 2/20 0.48
▸ PKM P14618 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALPL P05186 1/20 0.48
▸ ALPG P10696 1/20 0.48
▸ POLB P06746 1/20 0.45
▸ CASP3 P42574 1/20 0.45
▸ SENP7 Q9BQF6 1/20 0.45
▸ SENP6 Q9GZR1 1/20 0.45

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
SCHEMBL12359224 0.86 NPC1 (0.46) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL12653103 0.85 MEN1 (0.57) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL12359286 0.84 TRPV1 (0.60) RAB9ATRPV1
SCHEMBL12359235 0.84 TRPV1 (0.54) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL12359231 0.81 TRPV1 (0.52) TRPV1
SCHEMBL1798125 0.81 TRPV1 (0.64) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL1794736 0.81 TRPV1 (0.64) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL12359288 0.80 TRPV1 (0.46) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL12359282 0.80 TRPV1 (0.55) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL12358823 0.79 TRPV1 (0.44) NPC1RAB9AKDM4EALDH1A1LMNA

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 NPC1 750/4885RAB9A 3985/4885KDM4E 2796/4885

“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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