SCHEMBL24920816

SCHEMBL24920816

COc1ncc(F)c(-c2ncno2)n1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.31
CYP1A2 P05177 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
CYP3A4 P08684 1/20 0.31
KMT2A Q03164 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL24920831 0.77 LRRK2 (0.36) PDE10A
SCHEMBL24920864 0.74 MAPT (0.39) ALDH1A1
SCHEMBL24920807 0.74 LRRK2 (0.36) CYP1A2MEN1ALDH1A1GLACYP3A4
SCHEMBL24921528 0.73 FTO (0.37) PDE10A
SCHEMBL24920896 0.72 CYP1A2 (0.31) CYP1A2MEN1ALDH1A1GLACYP3A4
SCHEMBL24920791 0.72 GUCY1B2 (0.35) PDE10AALDH1A1GLAKMT2AHSD17B10
SCHEMBL24921585 0.72 PDE10A (0.35) PDE10A
SCHEMBL24920776 0.71 L3MBTL1 (0.36) ALDH1A1HSD17B10
SCHEMBL24921964 0.69 PDE10A (0.31) PDE10A
SCHEMBL24920818 0.69 CYP1A2 (0.33) CYP1A2MEN1ALDH1A1GLACYP3A4

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