SCHEMBL29317115

SCHEMBL29317115

CC(C)N1CCC2(CCN(CC3CCN(C)C3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.33
CYP1A2 P05177 2/20 0.33
NCF1 P14598 1/20 0.32
CACNA2D1 P54289 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNB1 Q02641 1/20 0.31
CACNA1C Q13936 1/20 0.31
TLR9 Q9NR96 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
ALOX15 P16050 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
SCHEMBL22520701 0.92 CACNA2D1 (0.36) CYP2D6CYP1A2NCF1CACNA2D1CACNA1B
SCHEMBL27013290 0.89 HRH3 (0.33) CYP2D6CYP1A2NCF1HRH3
SCHEMBL22520604 0.87 HRH3 (0.36) CYP2D6TLR9TLR8TLR7SMN1; SMN2
SCHEMBL25565564 0.85 CACNA2D1 (0.37) CYP2D6CYP1A2NCF1CACNA2D1CACNA1B
SCHEMBL27323574 0.85 CACNA2D1 (0.37) CYP2D6CYP1A2NCF1CACNA2D1CACNA1B
SCHEMBL23598175 0.85 CACNA2D1 (0.37) CYP2D6CYP1A2NCF1CACNA2D1CACNA1B
SCHEMBL24480642 0.85 NCF1 (0.41) CYP2D6CYP1A2NCF1CACNA2D1CACNA1B
SCHEMBL27307184 0.83 OPRM1 (0.38) NCF1CACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL22520762 0.81 ACHE (0.35) CYP2D6TLR9TLR8TLR7SMN1; SMN2
SCHEMBL24475331 0.80 CYP2D6 (0.33) CYP2D6SMN1; SMN2HRH3

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