SCHEMBL24920889

SCHEMBL24920889

Cc1ccc(C2(c3ccc(OCc4ccnc(-c5ncns5)n4)cc3)CCC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALOX5AP P20292 6/20 0.34
HPGD P15428 1/20 0.33
PSMB1 P20618 1/20 0.31
PSMB5 P28074 1/20 0.31
PSMB2 P49721 1/20 0.31
HSD11B1 P28845 1/20 0.30
HSD11B2 P80365 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL24920730 0.89 NPC1 (0.35) NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920863 0.83 NPC1 (0.37) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24921639 0.81 NPC1 (0.38) NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920909 0.80 NPC1 (0.38) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24920888 0.80 NPC1 (0.36) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24921215 0.80 NPC1 (0.40) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24920850 0.80 ALOX5AP (0.35) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24920854 0.80 ALOX5AP (0.34) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24920861 0.78 NPC1 (0.38) NPC1RAB9ASMN1; SMN2ALOX5APHPGD
SCHEMBL24921252 0.77 NPC1 (0.39) NPC1RAB9ASMN1; SMN2ALOX5APHPGD

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