SCHEMBL30141432

SCHEMBL30141432

CS(=O)(=O)c1cc(NC(=O)c2c(CC(F)(F)F)c(C3CC3)nn2CC2CCOCC2)ccn1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 13/20 0.42
RAF1 P04049 5/20 0.36
BRAF P15056 5/20 0.36
NR3C1 P04150 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35

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
SCHEMBL24906222 1.00 SCN10A (0.42) SCN10ARAF1BRAFNR3C1AKR1C3
SCHEMBL24906422 0.89 SCN10A (0.44) SCN10ARAF1BRAFAKR1C3AKR1C2
SCHEMBL30141382 0.86 SCN10A (0.40) SCN10ARAF1BRAFNR3C1
SCHEMBL24906218 0.86 SCN10A (0.40) SCN10ARAF1BRAFNR3C1
SCHEMBL24758389 0.84 SCN10A (0.38) SCN10ARAF1BRAFNR3C1
SCHEMBL30141366 0.79 SCN10A (0.45) SCN10A
SCHEMBL24906328 0.79 SCN10A (0.45) SCN10A
SCHEMBL24906504 0.78 SCN10A (0.45) SCN10A
SCHEMBL24906303 0.77 SCN10A (0.43) SCN10A
SCHEMBL24906475 0.76 SCN10A (0.43) SCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 EP claimed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 WO claimed
EP-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 EP disclosed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 WO disclosed