SCHEMBL25837401

SCHEMBL25837401

Ic1nc(-c2cccc3c2sc2ccccc23)nc(-c2cccc3c2sc2ccccc23)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.47
PARP14 Q460N5 1/20 0.43
GPR3 P46089 1/20 0.41
MAPT P10636 2/20 0.40
PRKDC P78527 7/20 0.39
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BRD4 O60885 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
PIK3CG P48736 1/20 0.35
KCNH2 Q12809 1/20 0.35
BRDT Q58F21 1/20 0.35
LIMK1 P53667 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 0.34
HTT P42858 1/20 0.33
PAX8 Q06710 1/20 0.33

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
SCHEMBL10029285 0.92 ALOX5 (0.53) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL18415772 0.84 PARP14 (0.47) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL19501990 0.84 ALOX5 (0.47) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL17232201 0.84 ALOX5 (0.50) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL15501880 0.84 ALOX5 (0.50) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL25050228 0.83 ALOX5 (0.46) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL22888552 0.83 ALOX5 (0.46) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL22084202 0.83 ALOX5 (0.49) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL21148752 0.83 ALOX5 (0.46) ALOX5PARP14GPR3MAPTPRKDC
SCHEMBL22888852 0.83 ALOX5 (0.46) ALOX5PARP14GPR3MAPTPRKDC

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
US-20230225203-A1 ORGANIC LUMINESCENT ELEMENT KYULUX, INC. (JP) 2023-07-13 US disclosed