SCHEMBL30141403

SCHEMBL30141403

Cc1nn(CC2CCC(F)(F)CC2)c(C(=O)Nc2cnnc(S(C)(=O)=O)c2)c1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
SCN10A Q9Y5Y9 8/20 0.34
CRHR1 P34998 4/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 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
SCHEMBL24906480 1.00 NR3C1 (0.36) NR3C1AKR1C3AKR1C2SCN10ACRHR1
SCHEMBL24758439 0.87 SCN10A (0.46) SCN10A
SCHEMBL30141517 0.86 SCN10A (0.42) NR3C1AKR1C3AKR1C2SCN10ACRHR1
SCHEMBL24757796 0.86 NR3C1 (0.37) NR3C1AKR1C3AKR1C2SCN10ACRHR1
SCHEMBL30141500 0.86 NR3C1 (0.37) NR3C1AKR1C3AKR1C2CRHR1CNR1
SCHEMBL24758421 0.86 SCN10A (0.42) NR3C1AKR1C3AKR1C2SCN10ACRHR1
SCHEMBL24758186 0.86 NR3C1 (0.37) NR3C1AKR1C3AKR1C2CRHR1CNR1
SCHEMBL24906499 0.83 AKR1C3 (0.44) NR3C1AKR1C3AKR1C2SCN10A
SCHEMBL24758288 0.82 SCN10A (0.45) SCN10A
SCHEMBL24906387 0.80 CRHR1 (0.41) NR3C1AKR1C3AKR1C2CRHR1

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