SCHEMBL20158583

SCHEMBL20158583

c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc(-c5ccncc5)c5cnccc45)c3)c3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.50
PIK3CA P42336 2/20 0.41
DYRK1A Q13627 2/20 0.40
MGAT2 Q10469 1/20 0.40
NOTUM Q6P988 1/20 0.40
CYP17A1 P05093 1/20 0.39
CYP1A2 P05177 1/20 0.39
AURKA O14965 1/20 0.39
CDK1 P06493 1/20 0.39
LYN P07948 1/20 0.39
PIM1 P11309 1/20 0.39
FGFR1 P11362 1/20 0.39
PRKACA P17612 1/20 0.39
RPS6KB1 P23443 1/20 0.39
CDK2 P24941 1/20 0.39
MARK3 P27448 1/20 0.39
AKT1 P31749 1/20 0.39
GSK3B P49841 1/20 0.39
RPS6KA3 P51812 1/20 0.39
PRKCZ Q05513 1/20 0.39

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
SCHEMBL1102927 0.86 TNF (0.47) TNFNOTUMAURKAPIM1ALOX5
SCHEMBL1102701 0.86 TNF (0.47) TNFNOTUMAURKAPIM1ALOX5
SCHEMBL1102751 0.84 TNF (0.54) TNFPIK3CADYRK1ANOTUMCYP17A1
SCHEMBL1102588 0.84 TNF (0.60) TNFALOX5DGAT2KDM4EALDH1A1
SCHEMBL10016743 0.83 NOTUM (0.48) TNFPIK3CANOTUMPRKACACDK2
SCHEMBL22955396 0.83 NOTUM (0.44) TNFPIK3CANOTUMAURKACDK1
SCHEMBL9613015 0.83 PIK3CA (0.51) TNFPIK3CANOTUMAURKACDK1
SCHEMBL29595669 0.83 NOTUM (0.48) TNFPIK3CANOTUMPRKACACDK2
SCHEMBL1102642 0.83 TNF (0.53) TNFPIK3CADYRK1AMGAT2NOTUM
SCHEMBL1102555 0.83 TNF (0.45) TNFPIK3CANOTUMAURKAPIM1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10347842-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-09 US disclosed
US-20180138417-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2018-05-17 US disclosed
US-20180138417-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2018-05-17 US disclosed