SCHEMBL25565671

SCHEMBL25565671

CC1CCN(CCOC2CCN(C)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.53
▸ CARM1 Q86X55 1/20 0.44
▸ PRMT6 Q96LA8 1/20 0.44
▸ PRMT1 Q99873 1/20 0.44
▸ PRMT8 Q9NR22 1/20 0.44
▸ SIGMAR1 Q99720 3/20 0.43
▸ KDM4E B2RXH2 4/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39
▸ RECQL P46063 1/20 0.39
▸ HRH3 Q9Y5N1 6/20 0.39
▸ ACHE P22303 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37

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
SCHEMBL25571582 0.86 NPC1 (0.64) NPC1CARM1PRMT6PRMT8SIGMAR1
SCHEMBL25621681 0.85 NPC1 (0.53) NPC1CARM1PRMT6PRMT8SIGMAR1
SCHEMBL27097601 0.83 NPC1 (0.50) NPC1CARM1PRMT6PRMT1PRMT8
SCHEMBL13367 0.83 NPC1 (0.66) NPC1CYP1A2HRH3
SCHEMBL26949128 0.83 NPC1 (0.47) NPC1CARM1PRMT6PRMT1PRMT8
SCHEMBL27271088 0.80 NPC1 (0.45) NPC1CARM1PRMT6PRMT1PRMT8
SCHEMBL18713115 0.80 NPC1 (0.67) NPC1KDM4EHRH3KMT2AALDH1A1
SCHEMBL13086520 0.80 NPC1 (0.52) NPC1SIGMAR1KDM4ECYP1A2TDP1
SCHEMBL12829 0.80 KDM4E (0.49) NPC1KDM4ETDP1HRH3LMNA
SCHEMBL12449678 0.80 KDM4E (0.49) NPC1KDM4ETDP1HRH3LMNA

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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