SCHEMBL29317307

SCHEMBL29317307

CC(C)N1CCC(CN2CCC(C3CCNCC3)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 7/20 0.43
GNAO1 P09471 7/20 0.43
GNAI1 P63096 6/20 0.43
HRH3 Q9Y5N1 4/20 0.36
ACHE P22303 1/20 0.36
TLR9 Q9NR96 3/20 0.34
TLR8 Q9NR97 3/20 0.34
TLR7 Q9NYK1 3/20 0.34
CACNA2D1 P54289 1/20 0.34
CACNA1B Q00975 1/20 0.34
CACNB1 Q02641 1/20 0.34
GBA1 P04062 1/20 0.33
CHRM5 P08912 1/20 0.32
ADRA2C P18825 1/20 0.32

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
SCHEMBL29317410 0.87 POLB (0.36) GNAI3GNAO1GNAI1HRH3ACHE
SCHEMBL22560635 0.86 HRH3 (0.40) GNAO1HRH3ACHETLR9TLR8
SCHEMBL3996073 0.84 GNAI3 (0.42) GNAI3GNAO1GNAI1HRH3
SCHEMBL24319479 0.83 CACNA2D1 (0.43) GNAO1HRH3ACHECACNA2D1CACNA1B
SCHEMBL13801431 0.82 GNAI3 (0.49) GNAI3GNAO1GNAI1ACHECACNA2D1
SCHEMBL24480645 0.81 GNAO1 (0.50) GNAI3GNAO1GNAI1HRH3ACHE
SCHEMBL24233173 0.81 ACHE (0.44) HRH3ACHETLR9TLR8TLR7
SCHEMBL22520769 0.80 CHRM5 (0.43) HRH3ACHETLR9TLR8TLR7
SCHEMBL25143962 0.79 ACHE (0.35) HRH3ACHETLR9TLR8TLR7
SCHEMBL25482583 0.79 ACHE (0.42) HRH3ACHETLR9TLR8TLR7

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
EP-4397661-A1 COMPOUND FOR DEGRADATION OF BCL-2 FAMILY PROTEINS AND MEDICAL APPLICATION THEREOF Xizang Haisco Pharmaceutical Co., Ltd. (CN) 2024-07-10 EP disclosed