SCHEMBL23134802

SCHEMBL23134802

C=C(C)C1CCN(CC2CCN(C(C)C)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ HRH3 Q9Y5N1 7/20 0.36
▸ TLR9 Q9NR96 3/20 0.32
▸ TLR8 Q9NR97 3/20 0.32
▸ TLR7 Q9NYK1 3/20 0.32
▸ CHRM5 P08912 1/20 0.32
▸ ADRA2C P18825 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ SMYD3 Q9H7B4 1/20 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
SCHEMBL22305194 0.84 HRH3 (0.38) HRH3KCNH2KDM4EALDH1A1PKM
SCHEMBL24233173 0.81 ACHE (0.44) ACHEHRH3TLR9TLR8TLR7
SCHEMBL22520769 0.80 CHRM5 (0.43) ACHEHRH3TLR9TLR8TLR7
SCHEMBL26263465 0.79 SMN1; SMN2 (0.42) SMN1; SMN2ACHEHRH3POLBKCNH2
SCHEMBL25075217 0.79 SMN1; SMN2 (0.42) SMN1; SMN2ACHEHRH3POLBKCNH2
SCHEMBL25482583 0.79 ACHE (0.42) ACHEHRH3TLR9TLR8TLR7
SCHEMBL14453909 0.79 CHRM5 (0.41) ACHEHRH3TLR9TLR8TLR7
SCHEMBL23484949 0.78 ACHE (0.60) ACHEHRH3TLR9TLR8TLR7
SCHEMBL26497170 0.78 ACHE (0.41) ACHEHRH3TLR9TLR8TLR7
SCHEMBL24548062 0.77 HRH3 (0.39) ACHEHRH3CHRM5ADRA2CKCNH2

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-2021055295-A1 BRD9 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-03-25 — — WO disclosed
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