SCHEMBL26466012

SCHEMBL26466012

Cc1cc(F)cc(NC(=O)CN2CC3CC(C2)N3CC(=O)NC2(C(F)(F)F)CC2)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 7/20 0.45
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ATM Q13315 1/20 0.36
DRD4 P21917 3/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL26465080 0.89 CACNA1H (0.56) CACNA1HMEN1KMT2A
SCHEMBL26466006 0.88 CACNA1H (0.53) CACNA1HMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL26465563 0.84 CACNA1H (0.42) CACNA1HMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL26465689 0.84 CACNA1H (0.54) CACNA1HMEN1KMT2AATMDRD4
SCHEMBL26466097 0.82 CACNA1H (0.45) CACNA1HMEN1KMT2AALDH1A1
SCHEMBL26465564 0.81 CACNA1H (0.43) CACNA1HMEN1KMT2AATMALDH1A1
SCHEMBL26465688 0.80 HPGD (0.53) CACNA1HMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL26465813 0.80 MAPT (0.43) CACNA1HALDH1A1SMN1; SMN2
SCHEMBL26465825 0.80 ALDH1A1 (0.44) CACNA1HMEN1KMT2AATMALDH1A1
SCHEMBL26466009 0.80 CACNA1H (0.49) CACNA1HMEN1KMT2AALDH1A1SMN1; SMN2

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