SCHEMBL20406282

SCHEMBL20406282

COCC(F)(F)c1ccc(Oc2ncncc2I)cn1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.31
▸ SCN10A Q9Y5Y9 1/20 0.31

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
SCHEMBL20755006 0.86 HDAC1 (0.34) SCN9ASCN10A
SCHEMBL20755016 0.83 TRPV4 (0.39) SCN9ASCN10A
SCHEMBL20394479 0.78 ABL1 (0.37) —
SCHEMBL20754954 0.76 SCN9A (0.33) SCN9ASCN10A
SCHEMBL20754998 0.76 CYP17A1 (0.36) SCN9A
SCHEMBL20406073 0.73 PDE10A (0.35) SCN9ASCN10A
SCHEMBL20394303 0.72 PDE10A (0.40) —
SCHEMBL20406228 0.72 EGFR (0.42) SCN9A
SCHEMBL20406664 0.70 CSF1R (0.34) SCN9A
SCHEMBL20406096 0.70 — —

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
EP-3351533-A1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME Kaken Pharmaceutical Co., Ltd. (JP) 2018-07-25 — — EP disclosed
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