SCHEMBL24920727

SCHEMBL24920727

Cc1ccc(C2(c3ccc(OCc4ccnc(-c5ncno5)n4)cc3)COC2)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
GAA P10253 1/20 0.34
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
HPGD P15428 1/20 0.33
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MAPT P10636 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
SCHEMBL24920854 0.90 ALOX5AP (0.34) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920745 0.86 NPC1 (0.35) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920723 0.84 NPC1 (0.35) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920751 0.83 RAB9A (0.47) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24921666 0.81 NPC1 (0.36) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920725 0.81 NPC1 (0.33) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920730 0.81 NPC1 (0.35) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920749 0.80 NPC1 (0.36) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920736 0.80 NPC1 (0.34) NPC1RAB9ASMN1; SMN2GAACASP3
SCHEMBL24920743 0.80 NPC1 (0.36) NPC1RAB9ASMN1; SMN2GAACASP3

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