SCHEMBL24920850

SCHEMBL24920850

Cc1ccc(C2(c3ccc(OCc4ccnc(-c5ncco5)n4)cc3)CCC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 6/20 0.35
NPC1 O15118 6/20 0.35
RAB9A P51151 6/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
HPGD P15428 1/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
PSMB1 P20618 1/20 0.32
PSMB5 P28074 1/20 0.32
PSMB2 P49721 1/20 0.32
HSD11B1 P28845 1/20 0.32
HSD11B2 P80365 1/20 0.32
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NFKB1 P19838 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
SCHEMBL24920745 0.89 NPC1 (0.35) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24922739 0.88 RAB9A (0.47) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920854 0.86 ALOX5AP (0.34) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920911 0.83 LMNA (0.35) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920877 0.83 NPC1 (0.35) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920886 0.83 HSD11B1 (0.38) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920852 0.83 NPC1 (0.34) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24921215 0.83 NPC1 (0.40) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920884 0.82 ALOX5AP (0.35) ALOX5APNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920880 0.81 NR1I2 (0.39) ALOX5APNPC1RAB9ASMN1; SMN2HPGD

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