SCHEMBL30141370

SCHEMBL30141370

Cc1ncc(NC(=O)c2c(C(F)(F)F)c(C)nn2CC2CCC(F)(F)CC2)cc1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.41
NR3C1 P04150 8/20 0.41
RIPK1 Q13546 1/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
CRHR2 Q13324 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
SCHEMBL24906387 1.00 CRHR1 (0.41) CRHR1NR3C1RIPK1AKR1C3AKR1C2
SCHEMBL24757816 0.87 NR3C1 (0.40) CRHR1NR3C1AKR1C3AKR1C2
SCHEMBL30106989 0.87 NR3C1 (0.40) CRHR1NR3C1AKR1C3AKR1C2
SCHEMBL30141383 0.86 NR3C1 (0.42) NR3C1AKR1C3AKR1C2
SCHEMBL24757325 0.86 NR3C1 (0.42) NR3C1AKR1C3AKR1C2
SCHEMBL24758991 0.86 CRHR1 (0.37) CRHR1NR3C1
SCHEMBL24757796 0.86 NR3C1 (0.37) CRHR1NR3C1AKR1C3AKR1C2
SCHEMBL24758985 0.85 ANO1 (0.46) NR3C1AKR1C3AKR1C2
SCHEMBL24906354 0.83 CRHR1 (0.36) CRHR1NR3C1AKR1C3AKR1C2
SCHEMBL24759017 0.83 AKR1C3 (0.45) NR3C1AKR1C3AKR1C2

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