SCHEMBL31443553

SCHEMBL31443553

C[C@H](/C=C/S(C)(=O)=O)NC(=O)c1ccc(N2CCSCC2c2ccccc2Cl)cc1F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.32
NR1H3 Q13133 2/20 0.32
SCN9A Q15858 2/20 0.32
NR1H4 Q96RI1 4/20 0.32
F10 P00742 1/20 0.31
RORC P51449 1/20 0.31
IDO1 P14902 1/20 0.31
MAPK1 P28482 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
SCHEMBL31443697 0.88 SCN9A (0.41) NR1H2NR1H3SCN9AF10RORC
SCHEMBL31443472 0.87 SCN9A (0.39) NR1H2NR1H3SCN9AF10RORC
SCHEMBL31443523 0.87 SCN9A (0.39) NR1H2NR1H3SCN9AF10RORC
SCHEMBL31443496 0.86 MAPK1 (0.36) NR1H2NR1H3SCN9ANR1H4MAPK1
SCHEMBL31443526 0.86 SCN9A (0.34) NR1H2NR1H3SCN9ANR1H4F10
SCHEMBL31443518 0.86 MAPK1 (0.36) NR1H2NR1H3SCN9ANR1H4MAPK1
SCHEMBL31443473 0.85 MEN1 (0.35) NR1H2NR1H3SCN9ANR1H4MAPK1
SCHEMBL31444591 0.85 MEN1 (0.35) NR1H2NR1H3SCN9ANR1H4MAPK1
SCHEMBL31443447 0.85 NR1H2 (0.32) NR1H2NR1H3SCN9ARORC
SCHEMBL31443607 0.85 SCN9A (0.34) NR1H2NR1H3SCN9ANR1H4MAPK1

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
WO-2025072451-A1 RAS-PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNOLOGICAL DISEASES VIVIDION THERAPEUTICS, INC. (US) 2025-04-03 WO claimed
WO-2025072451-A1 RAS-PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNOLOGICAL DISEASES VIVIDION THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed