SCHEMBL24824801

SCHEMBL24824801

Clc1nc(-c2ccc3sc4ccccc4c3c2)nc(-c2cccc3sc4ccccc4c23)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
GPR3 P46089 1/20 0.35
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 1/20 0.33
BRDT Q58F21 1/20 0.32
MAOB P27338 1/20 0.32
MAPT P10636 4/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADK P55263 1/20 0.31
PIM3 Q86V86 1/20 0.31
POLB P06746 3/20 0.31
TDP1 Q9NUW8 2/20 0.31
CTDSP1 Q9GZU7 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
DUSP3 P51452 1/20 0.31
BLM P54132 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
SCHEMBL21148613 0.94 GPR3 (0.40) ALOX5GPR3KDM4ECYP1A2BRDT
SCHEMBL25586144 0.93 ALOX5 (0.33) ALOX5GPR3KDM4EBRDTMAOB
SCHEMBL25706392 0.93 MAPT (0.37) ALOX5GPR3KDM4EBRDTMAOB
SCHEMBL21149238 0.90 ALOX5 (0.37) ALOX5GPR3CYP1A2BRDTMAOB
SCHEMBL25730550 0.90 ALOX5 (0.37) ALOX5GPR3KDM4ECYP1A2BRDT
SCHEMBL22133387 0.89 S1PR5 (0.37) ALOX5CYP1A2BRDTSMN1; SMN2ADK
SCHEMBL21148246 0.89 ALOX5 (0.39) ALOX5GPR3CYP1A2BRDTMAOB
SCHEMBL21149233 0.89 PIM3 (0.39) ALOX5GPR3KDM4ECYP1A2BRDT
SCHEMBL22274495 0.89 KDM4E (0.37) ALOX5GPR3KDM4ECYP1A2MAOB
SCHEMBL25132309 0.89 PIM3 (0.37) ALOX5GPR3KDM4EMAPTALDH1A1

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-2022270741-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING DEVICE 엘티소재주식회사 2022-12-29 WO disclosed