SCHEMBL22565038

SCHEMBL22565038

N#Cc1ccc(OC2CCC(NC(=O)c3ncccn3)CC2)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AR P10275 16/20 0.72
PGR P06401 2/20 0.58
TNKS O95271 2/20 0.52
PARP1 P09874 1/20 0.52
PARP2 Q9UGN5 1/20 0.52
TNKS2 Q9H2K2 1/20 0.51

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
SCHEMBL22566109 1.00 AR (0.72) ARPGRTNKSPARP1PARP2
SCHEMBL22557880 0.91 AR (0.66) ARPGRTNKSPARP1PARP2
SCHEMBL22557879 0.91 AR (0.66) ARPGRTNKSPARP1PARP2
SCHEMBL22564952 0.90 AR (0.73) ARPGRTNKSPARP1PARP2
SCHEMBL22565013 0.90 AR (0.79) ARPGRTNKSPARP1PARP2
SCHEMBL22565749 0.90 AR (0.79) ARPGRTNKSPARP1PARP2
SCHEMBL22557804 0.89 AR (0.64) ARPGRTNKSPARP1PARP2
SCHEMBL20046577 0.89 AR (0.64) ARPGRTNKSPARP1PARP2
SCHEMBL22557805 0.89 AR (0.64) ARPGRTNKSPARP1PARP2
SCHEMBL30349579 0.89 AR (0.64) ARPGRTNKSPARP1PARP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3957633-A1 A CLASS OF BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUNDS FOR TARGETED DEGRADATION OF ANDROGEN RECEPTORS AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2022-02-23 EP disclosed
WO-2020211822-A1 A CLASS OF BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUNDS FOR TARGETED DEGRADATION OF ANDROGEN RECEPTORS AND USE THEREOF 成都海创药业有限公司 2020-10-22 WO disclosed