SCHEMBL30141517

SCHEMBL30141517

Cc1nn(CC2CCC(F)(F)CC2)c(C(=O)Nc2cncc(S(C)(=O)=O)c2)c1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 10/20 0.42
NR3C1 P04150 5/20 0.37
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
P2RX7 Q99572 1/20 0.35
CRHR1 P34998 2/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL24758421 1.00 SCN10A (0.42) SCN10ANR3C1AKR1C3AKR1C2P2RX7
SCHEMBL24906499 0.88 AKR1C3 (0.44) SCN10ANR3C1AKR1C3AKR1C2P2RX7
SCHEMBL30141403 0.86 NR3C1 (0.36) SCN10ANR3C1AKR1C3AKR1C2CRHR1
SCHEMBL24906480 0.86 NR3C1 (0.36) SCN10ANR3C1AKR1C3AKR1C2CRHR1
SCHEMBL24906217 0.85 SCN10A (0.43) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL30141357 0.85 SCN10A (0.43) SCN10AAKR1C3AKR1C2P2RX7CNR1
SCHEMBL24758439 0.83 SCN10A (0.46) SCN10A
SCHEMBL24757353 0.83 SCN10A (0.48) SCN10AAKR1C3AKR1C2
SCHEMBL24906294 0.81 SCN10A (0.39) SCN10ANR3C1AKR1C3AKR1C2
SCHEMBL24906339 0.81 SCN10A (0.48) SCN10AAKR1C3AKR1C2

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
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