SCHEMBL26466237

SCHEMBL26466237

CC(C)(C)NC(=O)CN1C[C@@H]2C[C@H]1CN2CC(=O)Nc1cc(F)cc(OC(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 11/20 0.54
LTA4H P09960 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.35
CACNA1G O43497 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 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
SCHEMBL26466406 1.00 CACNA1H (0.54) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26466222 1.00 CACNA1H (0.54) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26466386 0.92 CACNA1H (0.45) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26466770 0.89 CACNA1H (0.42) CACNA1HLTA4HMEN1KMT2ALMNA
SCHEMBL26466617 0.89 CACNA1H (0.67) CACNA1HLTA4HMEN1KMT2AKDM4E
SCHEMBL26466598 0.87 CACNA1H (0.46) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26466207 0.87 CACNA1H (0.46) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26499134 0.85 CACNA1H (0.51) CACNA1HMEN1KMT2AKDM4ELMNA
SCHEMBL26466398 0.83 CACNA1H (0.49) CACNA1HLTA4HCACNA1GCACNA1IALDH1A1
SCHEMBL26466387 0.83 CACNA1H (0.49) CACNA1HLTA4HCACNA1GCACNA1IALDH1A1

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-2023192669-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING A PIPERAZINE OR 1,4-DIAZEPANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2023-10-05 WO disclosed