SCHEMBL12653207

SCHEMBL12653207

C=C(O)c1ccccc1-c1ccc2[nH]c(C3CC3c3ccc(OCC(F)(F)C(F)(F)F)cc3)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 3/20 0.37
▸ SCN5A Q14524 2/20 0.37
▸ HCRTR1 O43613 3/20 0.31
▸ HCRTR2 O43614 3/20 0.31
▸ ROCK2 O75116 3/20 0.31
▸ PRCP P42785 1/20 0.30
▸ RET P07949 1/20 0.30
▸ TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL12359093 0.91 MEN1 (0.31) HCRTR1HCRTR2ROCK2PRCP
SCHEMBL1797801 0.89 TRPV1 (0.38) SCN9ASCN5AHCRTR1HCRTR2ROCK2
SCHEMBL1801613 0.85 TRPV1 (0.41) SCN9ASCN5APRCPRETTRPV1
SCHEMBL1796849 0.85 TRPV1 (0.38) SCN9ASCN5APRCPRETTRPV1
SCHEMBL12358862 0.84 HCRTR1 (0.41) HCRTR1HCRTR2ROCK2
SCHEMBL12358844 0.83 SCN5A (0.40) SCN9ASCN5A
SCHEMBL1800044 0.83 TRPV1 (0.43) SCN9ASCN5ATRPV1
SCHEMBL1796434 0.83 TRPV1 (0.41) SCN9AHCRTR1HCRTR2PRCPTRPV1
SCHEMBL1796612 0.81 TRPV1 (0.42) SCN9ASCN5ATRPV1
SCHEMBL1793568 0.81 TRPV1 (0.51) TRPV1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951829-B2 Benzimidazole modulators of VR1 JANSSEN PHARMACEUTICA NV (BE) 2011-05-31 — — US disclosed
US-20070259936-A1 Benzimidazole Modulators of VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-08 — — 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-20070259936-A1 Benzimidazole Modulators of VR1 VRK1, VRK2, VIL1 SCN9A 1573/4885SCN5A 1082/4885HCRTR1 3055/4885

“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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