SCHEMBL30141357

SCHEMBL30141357

CS(=O)(=O)c1cncc(NC(=O)c2c(C(F)(F)F)cnn2CC2CCC(F)(F)CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 11/20 0.43
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
P2RX7 Q99572 3/20 0.36
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
PDE10A Q9Y233 1/20 0.33
FLT1 P17948 2/20 0.33
KDR P35968 2/20 0.33
NR1I2 O75469 1/20 0.33
CACNA1C Q13936 1/20 0.33
IL1B P01584 1/20 0.33

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
SCHEMBL24906217 1.00 SCN10A (0.43) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL30141414 0.89 AKR1C3 (0.35) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL24906460 0.89 AKR1C3 (0.45) SCN10AAKR1C3AKR1C2P2RX7NR1I2
SCHEMBL24757790 0.89 AKR1C3 (0.35) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL30141517 0.85 SCN10A (0.42) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL24758421 0.85 SCN10A (0.42) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL24758348 0.83 CNR1 (0.39) AKR1C3AKR1C2P2RX7CNR1CNR2
SCHEMBL24758355 0.83 SCN10A (0.48) SCN10A
SCHEMBL24758261 0.83 P2RX7 (0.40) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL30141455 0.83 P2RX7 (0.40) SCN10AAKR1C3AKR1C2P2RX7CNR1

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