SCHEMBL26467004

SCHEMBL26467004

O=C(CN1C[C@@H]2C[C@H]1CN2CC(=O)NC1(C(F)(F)F)CC1)Nc1cc(F)c(F)c(OC(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 5/20 0.36
LTA4H P09960 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
SCHEMBL26464489 0.90 CACNA1H (0.38) CACNA1H
SCHEMBL26466912 0.89 CACNA1H (0.38) CACNA1HLTA4H
SCHEMBL26466922 0.89 CACNA1H (0.41) CACNA1HLTA4H
SCHEMBL26467001 0.85 LTA4H (0.38) CACNA1HLTA4H
SCHEMBL26466389 0.85 CACNA1H (0.40) CACNA1HLTA4H
SCHEMBL26466907 0.85 CACNA1H (0.40) CACNA1HLTA4H
SCHEMBL26466919 0.84 CACNA1H (0.42) CACNA1HLTA4H
SCHEMBL26466996 0.83 CACNA1H (0.41) CACNA1HLTA4H
SCHEMBL26465703 0.79 CACNA1H (0.40) CACNA1H
SCHEMBL26465564 0.79 CACNA1H (0.43) CACNA1H

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