SCHEMBL24922287

SCHEMBL24922287

CC(C)(c1ccc(CC2CCC2)cc1)c1ccc(Oc2ccc(-n3cccn3)nc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRN P28799 1/20 0.37
SORT1 Q99523 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 1/20 0.34
CXCR4 P61073 1/20 0.34
KDM4E B2RXH2 2/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
FAAH O00519 2/20 0.34
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LIPE Q05469 1/20 0.33
MGLL Q99685 1/20 0.33
CHRNA7 P36544 1/20 0.33
LTA4H P09960 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL24922128 0.81 KMT2A (0.52) GRNSORT1KMT2AMEN1CYP1A2
SCHEMBL27233916 0.77 CHRNA7 (0.39) GRNSORT1KMT2AMEN1CYP1A2
SCHEMBL27233918 0.77 CHRNA7 (0.39) GRNSORT1KMT2AMEN1CYP1A2
SCHEMBL24921037 0.73 LTA4H (0.30) LTA4HHRH3
SCHEMBL27233975 0.72 KMT2A (0.40) GRNSORT1KMT2AMEN1CYP1A2
SCHEMBL27233970 0.72 KMT2A (0.40) GRNSORT1KMT2AMEN1CYP1A2
SCHEMBL30212531 0.72 NPC1 (0.57) KMT2AMEN1CYP1A2CYP2C19LMNA
SCHEMBL24922131 0.70 KMT2A (0.39) KMT2AMEN1CYP1A2CYP2C19LMNA
SCHEMBL30988311 0.70 KMT2A (0.39) KMT2AMEN1CYP1A2CYP2C19LMNA
SCHEMBL24920613 0.70 ACACB (0.37) KMT2AMEN1CYP1A2LMNAHPGD

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