SCHEMBL26464642

SCHEMBL26464642

CC(C(=O)Nc1ccc(F)c(Cl)c1)N1CC2CC(C1)N2CC(=O)NC1(C(F)(F)F)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 2/20 0.44
TSHR P16473 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.40
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
SLC10A1 Q14973 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.38
IDO1 P14902 1/20 0.38
MCHR1 Q99705 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL26465817 0.87 CACNA1H (0.38) CACNA1HLMNAIDO1SMN1; SMN2
SCHEMBL26464641 0.86 HTT (0.48) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26465688 0.85 HPGD (0.53) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26466594 0.81 HPGD (0.49) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26466243 0.81 HPGD (0.49) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26466250 0.81 HPGD (0.49) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26465684 0.75 HPGD (0.54) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26465818 0.75 CACNA1H (0.42) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26466097 0.74 CACNA1H (0.45) CACNA1HTSHRKDM4EHPGDKMT2A
SCHEMBL26465813 0.74 MAPT (0.43) CACNA1HKDM4EHPGDLMNAALDH1A1

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