SCHEMBL25569155

SCHEMBL25569155

CC(C)N1CC[C@@H](CC2CCN(C)CC2)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 1/20 0.42
▸ HRH3 Q9Y5N1 7/20 0.34
▸ ACHE P22303 3/20 0.33
▸ SLC6A4 P31645 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MITF O75030 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HRH4 Q9H3N8 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
SCHEMBL24671761 0.90 NCF1 (0.46) NCF1HRH3ACHESLC6A4HRH4
SCHEMBL27323580 0.90 HRH3 (0.40) HRH3
SCHEMBL24501875 0.82 HRH3 (0.40) HRH3
SCHEMBL25565871 0.81 NCF1 (0.54) NCF1HRH3ACHESLC6A4HRH4
SCHEMBL22859167 0.81 NCF1 (0.54) NCF1HRH3ACHESLC6A4HRH4
SCHEMBL25480233 0.81 HRH3 (0.44) NCF1HRH3
SCHEMBL25566048 0.81 NCF1 (0.54) NCF1HRH3ACHESLC6A4HRH4
SCHEMBL23594654 0.80 HRH3 (0.33) HRH3
SCHEMBL12890856 0.79 HRH3 (0.43) HRH3
SCHEMBL757866 0.78 NCF1 (0.62) NCF1HRH3ACHEHRH4

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-2023083194-A1 WEE1 PROTEIN KINASE DEGRADATION AGENT AND USE THEREOF 杭州格博生物医药有限公司 2023-05-19 — — WO disclosed
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