SCHEMBL24920730

SCHEMBL24920730

Cc1ccc(C2(c3ccc(OCc4ccnc(-c5ncns5)n4)cc3)COC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
HPGD P15428 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
GAA P10253 1/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
MAPT P10636 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
SCHEMBL24920889 0.89 NPC1 (0.36) NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920746 0.83 NPC1 (0.37) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920745 0.81 NPC1 (0.35) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920727 0.81 NPC1 (0.34) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920722 0.81 NPC1 (0.37) NPC1RAB9ASMN1; SMN2HPGDPIK3CD
SCHEMBL24920743 0.81 NPC1 (0.36) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24921639 0.80 NPC1 (0.38) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920723 0.80 NPC1 (0.35) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920749 0.80 NPC1 (0.36) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920736 0.80 NPC1 (0.34) NPC1RAB9ASMN1; SMN2HPGDGAA

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