SCHEMBL31706166

SCHEMBL31706166

CC(C)(C)OC(=O)NCc1cc(F)c(C(F)(F)F)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.45
CACNA1B Q00975 1/20 0.45
CACNA1C Q13936 1/20 0.45
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
AAK1 Q2M2I8 4/20 0.38
KDM4A O75164 1/20 0.38
EPHX2 P34913 3/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
DDR1 Q08345 1/20 0.36
RPS6KA1 Q15418 1/20 0.36
KCNA5 P22460 1/20 0.35
NOTUM Q6P988 1/20 0.35
EPAS1 Q99814 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
IDO1 P14902 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
SCHEMBL25574990 0.81 AAK1 (0.49) CACNA1HCACNA1BCACNA1CLMNAAAK1
SCHEMBL28540922 0.81 SOS1 (0.40) CACNA1HCACNA1BCACNA1CAAK1KDM4A
SCHEMBL31706249 0.81 PTPN7 (0.36) LMNAEPHX2DDR1NOTUM
SCHEMBL29533276 0.79 AAK1 (0.45) CACNA1HCACNA1BCACNA1CLMNAAAK1
SCHEMBL22664847 0.79 AAK1 (0.45) CACNA1HCACNA1BCACNA1CLMNAAAK1
SCHEMBL24971039 0.78 CACNA1H (0.46) CACNA1HCACNA1BCACNA1CLMNAPOLB
SCHEMBL31704494 0.78 CACNA1H (0.46) CACNA1HCACNA1BCACNA1CKDM4AEPHX2
SCHEMBL29664091 0.78 CACNA1H (0.46) CACNA1HCACNA1BCACNA1CLMNAPOLB
SCHEMBL12656366 0.78 EPHX2 (0.46) CACNA1HCACNA1BCACNA1CLMNAPOLB
SCHEMBL16793735 0.78 AAK1 (0.44) CACNA1HCACNA1BCACNA1CPOLBAAK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 WO disclosed