SCHEMBL26466907

SCHEMBL26466907

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

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 4/20 0.40
LTA4H P09960 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
EPHX2 P34913 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RORC P51449 2/20 0.32
WNT3A P56704 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
IDH1 O75874 4/20 0.31

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
SCHEMBL26466389 1.00 CACNA1H (0.40) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26465563 0.89 CACNA1H (0.42) CACNA1HMEN1KMT2ACRHBPCRHR2
SCHEMBL26466903 0.89 CACNA1H (0.50) CACNA1HLTA4HMEN1KMT2AEPHX2
SCHEMBL26464769 0.86 LMNA (0.44) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL26467004 0.85 CACNA1H (0.36) CACNA1HLTA4H
SCHEMBL26466415 0.84 CACNA1H (0.53) CACNA1HLTA4HMEN1KMT2AALDH1A1
SCHEMBL26466233 0.84 CACNA1H (0.53) CACNA1HLTA4HMEN1KMT2AALDH1A1
SCHEMBL26466406 0.83 CACNA1H (0.54) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26466222 0.83 CACNA1H (0.54) CACNA1HLTA4HMEN1KMT2ACRHBP
SCHEMBL26466237 0.83 CACNA1H (0.54) CACNA1HLTA4HMEN1KMT2ACRHBP

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