SCHEMBL30141341

SCHEMBL30141341

CC(C)Oc1nn(CC2CCC(F)(F)C2)c(C(=O)Nc2ccnc(C(N)=O)c2)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 16/20 0.41
ANO1 Q5XXA6 1/20 0.41
GSK3B P49841 2/20 0.35
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 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
SCHEMBL24758318 1.00 SCN10A (0.41) SCN10AANO1GSK3BAKR1C3AKR1C2
SCHEMBL30141502 0.95 SCN10A (0.40) SCN10AANO1AKR1C3AKR1C2
SCHEMBL24906226 0.95 SCN10A (0.40) SCN10AANO1AKR1C3AKR1C2
SCHEMBL24757846 0.95 SCN10A (0.40) SCN10AANO1AKR1C3AKR1C2
SCHEMBL30141527 0.94 SCN10A (0.42) SCN10AANO1AKR1C3AKR1C2
SCHEMBL24758323 0.94 SCN10A (0.42) SCN10AANO1AKR1C3AKR1C2
SCHEMBL30141543 0.93 ANO1 (0.40) SCN10AANO1AKR1C3AKR1C2
SCHEMBL24758320 0.93 ANO1 (0.40) SCN10AANO1AKR1C3AKR1C2
SCHEMBL24906215 0.93 SCN10A (0.42) SCN10AANO1
SCHEMBL30141433 0.93 SCN10A (0.42) SCN10AANO1

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