SCHEMBL24920724

SCHEMBL24920724

Cc1ccc(C2(c3ccc(OCc4ccnc(-c5cnco5)n4)cc3)COC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
NPC1 O15118 5/20 0.33
RAB9A P51151 5/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
HPGD P15428 1/20 0.32
GAA P10253 1/20 0.31
KCNH2 Q12809 1/20 0.31
HRH3 Q9Y5N1 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
FFAR1 O14842 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
SCHEMBL24920911 0.90 LMNA (0.35) LMNAPKMCYP3A4CYP2D6NPC1
SCHEMBL24920723 0.84 NPC1 (0.35) LMNACYP2D6NPC1RAB9ASMN1; SMN2
SCHEMBL24920745 0.83 NPC1 (0.35) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24920751 0.82 RAB9A (0.47) LMNAPKMNPC1RAB9ASMN1; SMN2
SCHEMBL24920736 0.82 NPC1 (0.34) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL24921657 0.81 LMNA (0.38) LMNAPKMCYP3A4CYP2D6NPC1
SCHEMBL24920726 0.81 NPC1 (0.34) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920725 0.80 NPC1 (0.33) NPC1RAB9ASMN1; SMN2HPGDGAA
SCHEMBL24920749 0.80 NPC1 (0.36) LMNACYP2D6NPC1RAB9ASMN1; SMN2
SCHEMBL24920732 0.79 NPC1 (0.37) LMNAPKMNPC1RAB9ASMN1; SMN2

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