SCHEMBL24319649

SCHEMBL24319649

CN1CCC(CN2CC3CN(C)CC3(C)C2)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.42
NCF1 P14598 1/20 0.37
SCN1A P35498 1/20 0.36
SCN4A P35499 1/20 0.36
SCN7A Q01118 1/20 0.36
KCNH2 Q12809 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
SCN11A Q9UI33 1/20 0.36
SCN8A Q9UQD0 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36
CACNA2D1 P54289 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNB1 Q02641 1/20 0.35
CACNA1C Q13936 1/20 0.35
EPHX2 P34913 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL24319167 1.00 SIGMAR1 (0.42) SIGMAR1NCF1SCN1ASCN4ASCN7A
SCHEMBL24319338 0.83 SCN1A (0.46) SIGMAR1NCF1SCN1ASCN4ASCN7A
SCHEMBL18202953 0.73 SIGMAR1 (0.47) SIGMAR1SCN1ASCN4ASCN7AKCNH2
SCHEMBL20320096 0.73 SLC6A4 (0.34) KCNH2
SCHEMBL18685394 0.73 SLC6A4 (0.34) KCNH2
SCHEMBL24319185 0.72 NCF1 (0.39) SIGMAR1NCF1SCN1ASCN4ASCN7A
SCHEMBL25666707 0.72 NCF1 (0.42) SIGMAR1NCF1CACNA2D1CACNA1BCACNB1
SCHEMBL24319646 0.72 NCF1 (0.42) SIGMAR1NCF1CACNA2D1CACNA1BCACNB1
SCHEMBL24319165 0.72 NCF1 (0.42) SIGMAR1NCF1CACNA2D1CACNA1BCACNB1
SCHEMBL25666713 0.72 NCF1 (0.42) SIGMAR1NCF1CACNA2D1CACNA1BCACNB1

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-2022047145-A1 RAPIDLY ACCELERATING FIBROSARCOMA PROTEIN DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-03-03 WO disclosed