SCHEMBL24922693

SCHEMBL24922693

CC(C)(c1ccc(Oc2ccnc(-n3nccn3)n2)cc1)c1ccc(OC2CCC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 8/20 0.35
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TNK2 Q07912 2/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
PSMB1 P20618 1/20 0.31
PSMB5 P28074 1/20 0.31
PSMB2 P49721 1/20 0.31
MAPT P10636 3/20 0.31
PARP10 Q53GL7 1/20 0.31
FDPS P14324 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 2/20 0.30
HPGD P15428 2/20 0.30
TSHR P16473 2/20 0.30
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 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
SCHEMBL24921617 0.83 ACACB (0.36) ACACBMEN1KMT2ATNK2PSMB1
SCHEMBL24920648 0.79 ACACB (0.46) ACACBRAB9AMAPTPARP10LMNA
SCHEMBL24920613 0.79 ACACB (0.37) ACACBMEN1KMT2APSMB1PSMB5
SCHEMBL24922351 0.73 ACACB (0.38) ACACBMEN1KMT2AKDM4EPOLB
SCHEMBL30212445 0.72 ACACB (0.37) ACACBMEN1KMT2AMAPTPARP10
SCHEMBL24922311 0.71 AR (0.35) ACACBMEN1KMT2APSMB1PSMB5
SCHEMBL27234163 0.70 RAB9A (0.35) MEN1KMT2AKDM4EPOLBRAB9A
SCHEMBL27234158 0.70 RAB9A (0.35) MEN1KMT2AKDM4EPOLBRAB9A
SCHEMBL6135358 0.70 NPY1R (0.47) ACACBMEN1KMT2APSMB1PSMB5
SCHEMBL24920624 0.70 ACACB (0.38) ACACBKDM4EPOLBRAB9AMAPT

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