SCHEMBL31633178

SCHEMBL31633178

Cn1cc(-c2cccc(F)c2)c2ccc(C(=O)O)cc21

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 10/20 0.54
IDO1 P14902 1/20 0.49
TDO2 P48775 1/20 0.49
KDM4C Q9H3R0 1/20 0.46
DGAT2 Q96PD7 1/20 0.45
GSK3B P49841 2/20 0.45
BRD4 O60885 1/20 0.45
S1PR1 P21453 1/20 0.45
ASH1L Q9NR48 1/20 0.44
SCN5A Q14524 2/20 0.44
PRKCA P17252 1/20 0.43
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43

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
SCHEMBL120345 1.00 SCN9A (0.54) SCN9AIDO1TDO2KDM4CDGAT2
SCHEMBL31633145 0.86 SCN9A (0.53) SCN9AIDO1TDO2DGAT2GSK3B
SCHEMBL121474 0.86 SCN9A (0.68) SCN9ABRD4S1PR1ASH1LSCN5A
SCHEMBL121650 0.85 IDO1 (0.58) SCN9AIDO1TDO2S1PR1SCN5A
SCHEMBL121689 0.84 SCN9A (0.72) SCN9ADGAT2S1PR1SCN5A
SCHEMBL31632863 0.78 IDO1 (0.44) SCN9AIDO1TDO2GSK3BBRD4
SCHEMBL121389 0.77 SCN9A (0.70) SCN9AS1PR1SCN5A
SCHEMBL19475709 0.77 SCN9A (0.70) SCN9AIDO1TDO2SCN5A
SCHEMBL122571 0.77 SCN9A (0.67) SCN9ABRD4S1PR1ASH1LSCN5A
SCHEMBL6840324 0.77 SNCA (0.50) KDM4C

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
WO-2025129167-A1 INHIBITORS OF THE SURFACE EXPRESSION OF THE VOLTAGE-GATED SODIUM ION CHANNEL 1.7 (NAV1.7) AND THEIR THERAPEUTIC USES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2025-06-19 WO disclosed