SCHEMBL26408705

SCHEMBL26408705

Cc1cc(F)cc(NC(=O)C2CCC3(CC2)CN(CC(=O)NC2(C(F)(F)F)CC2)C3)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 1/20 0.40
CACNA1H O95180 2/20 0.39
POLB P06746 1/20 0.37
RXFP1 Q9HBX9 2/20 0.35
ACKR3 P25106 1/20 0.35
KDR P35968 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 2/20 0.33
FFAR4 Q5NUL3 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
DRD4 P21917 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL26408044 0.89 CACNA1H (0.48) CACNA1HMEN1KMT2AALDH1A1FFAR4
SCHEMBL26408251 0.88 CACNA1H (0.43) LMNACACNA1HACKR3ALDH1A1KDM4E
SCHEMBL26408701 0.87 NPSR1 (0.49) NPSR1MEN1KMT2AALDH1A1KDM4E
SCHEMBL26407873 0.86 ACKR3 (0.44) NPSR1LMNACACNA1HPOLBRXFP1
SCHEMBL26408706 0.85 CACNA1H (0.36) CACNA1HPOLBKDRFFAR4
SCHEMBL26408263 0.85 CACNA1H (0.42) LMNACACNA1HACKR3MEN1KMT2A
SCHEMBL26408948 0.84 SIGMAR1 (0.47) CACNA1HPOLBDRD4
SCHEMBL26411550 0.82 CACNA1H (0.42) CACNA1HPOLBMEN1KMT2AALDH1A1
SCHEMBL26408707 0.81 MGLL (0.43) LMNACACNA1HMEN1KMT2AALDH1A1
SCHEMBL26408939 0.81 NPY5R (0.43) KDRKMT2A

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-2023192675-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING AN AZASPIRONONANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2023-10-05 WO disclosed