SCHEMBL24920786

SCHEMBL24920786

COc1ccnc(-n2ncc(C)n2)n1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 11/20 0.37
HCRTR2 O43614 11/20 0.37
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
MAT2A P31153 1/20 0.34
OGA O60502 1/20 0.34
DYRK1A Q13627 1/20 0.33
ACVR2A P27037 1/20 0.33
TGFBR2 P37173 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
SCHEMBL24920384 0.81 HCRTR1 (0.47) HCRTR1HCRTR2MAT2AOGA
SCHEMBL24921179 0.75 LOX (0.39) MAT2ADYRK1AACVR2ATGFBR2
SCHEMBL24922002 0.74 MEN1 (0.30) MEN1CYP1A2KMT2A
SCHEMBL24921165 0.73 ALOX5 (0.40) CYP1A2KMT2AOGA
SCHEMBL16547539 0.72 NPSR1 (0.43) HCRTR1HCRTR2MAT2AOGAACVR2A
SCHEMBL24920770 0.72 PDE10A (0.42) CYP1A2DYRK1A
SCHEMBL24921999 0.71 OGA (0.33) HCRTR1HCRTR2OGAACVR2ATGFBR2
SCHEMBL24921589 0.71 MEN1 (0.44) MEN1KMT2AOGA
SCHEMBL24920876 0.71 HCRTR1 (0.30) HCRTR1HCRTR2
SCHEMBL24921166 0.70 CCR1 (0.46) CYP1A2DYRK1A

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