SCHEMBL12359282

SCHEMBL12359282

NSc1ccccc1-c1ccc2[nH]c(/C=C/c3ccc(F)c(F)c3)nc2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 18/20 0.55
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ PKM P14618 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.40

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
SCHEMBL12653103 0.88 MEN1 (0.57) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL12359235 0.88 TRPV1 (0.54) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL12359288 0.86 TRPV1 (0.46) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL12358823 0.84 TRPV1 (0.44) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL12350046 0.81 TRPV1 (0.52) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL1799694 0.81 TRPV1 (0.61) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL1799365 0.81 TRPV1 (0.70) TRPV1
SCHEMBL1799697 0.81 TRPV1 (0.61) TRPV1KDM4EMEN1NPC1ALDH1A1
SCHEMBL1799363 0.81 TRPV1 (0.70) TRPV1
SCHEMBL12359287 0.80 NPC1 (0.48) TRPV1KDM4EMEN1NPC1ALDH1A1

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 29/4885KDM4E 2796/4885MEN1 3925/4885

“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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