SCHEMBL24922745

SCHEMBL24922745

COC[C@@H]1CCN1CCOC[C@H]1CCN1C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.37
CHRNA3 P32297 2/20 0.33
CHRNB4 P30926 1/20 0.33
HDAC8 Q9BY41 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
HDAC1 Q13547 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
SCHEMBL23868178 0.82
SCHEMBL24917922 0.82
SCHEMBL20715280 0.82
SCHEMBL16541852 0.77 TRPV6 (0.40) GBA1HDAC8HDAC6HDAC1
SCHEMBL14207963 0.75 HDAC8 (0.46) GBA1HDAC8HDAC6HDAC1
SCHEMBL9921271 0.75 HDAC8 (0.46) GBA1HDAC8HDAC6HDAC1
SCHEMBL14207962 0.75 HDAC8 (0.46) GBA1HDAC8HDAC6HDAC1
SCHEMBL20330340 0.74 CHRNB4 (0.38) CHRNA3CHRNB4
SCHEMBL25541248 0.73 DRD2 (0.36) GBA1HDAC8HDAC6HDAC1
SCHEMBL25542061 0.73 DRD2 (0.36) GBA1HDAC8HDAC6HDAC1

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-2023006097-A1 BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER 海创药业股份有限公司 2023-02-02 WO disclosed