SCHEMBL24920843

SCHEMBL24920843

CNC(C)c1ccc(C#CCOCCCOCC(C)(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 17/20 0.33
▸ HTR2A P28223 2/20 0.32
▸ HTR2C P28335 2/20 0.32
▸ HTR2B P41595 2/20 0.32
▸ SIGMAR1 Q99720 2/20 0.32
▸ DRD2 P14416 1/20 0.31
▸ KCNH2 Q12809 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
SCHEMBL18591766 0.89 ACACB (0.33) ACACBHTR2AHTR2CHTR2BSIGMAR1
SCHEMBL26328562 0.89 ACACB (0.33) ACACBHTR2AHTR2CHTR2BSIGMAR1
SCHEMBL20325131 0.87 GRM5 (0.35) ACACBHTR2AHTR2CHTR2BSIGMAR1
SCHEMBL20324201 0.86 ACACB (0.39) ACACB
SCHEMBL18551213 0.85 ACACB (0.34) ACACBKCNH2
SCHEMBL18612041 0.85 HTR2A (0.33) HTR2AHTR2CHTR2BSIGMAR1DRD2
SCHEMBL25059246 0.82 ACACB (0.34) ACACB
SCHEMBL18611814 0.81 ACACB (0.41) ACACB
SCHEMBL18611812 0.81 ACACB (0.41) ACACB
SCHEMBL22047351 0.81 ACACB (0.41) ACACB

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
Send feedback