SCHEMBL19953869

SCHEMBL19953869

CN1C(=O)c2cccc(-n3c4ccccc4c4ccccc43)c2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 2/20 0.47
▸ TTR P02766 1/20 0.46
▸ CES1 P23141 1/20 0.46
▸ MEN1 O00255 6/20 0.44
▸ KMT2A Q03164 6/20 0.44
▸ USP2 O75604 3/20 0.44
▸ CASP1 P29466 2/20 0.44
▸ BRCA1 P38398 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ HPGD P15428 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ KEAP1 Q14145 2/20 0.43
▸ NFE2L2 Q16236 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ POLB P06746 3/20 0.41
▸ PRMT1 Q99873 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ HTT P42858 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
SCHEMBL23892809 0.94 CASP3 (0.42) CASP3TTRCES1MEN1KMT2A
SCHEMBL19850801 0.93 CASP3 (0.41) CASP3TTRCES1MEN1KMT2A
SCHEMBL19850804 0.88 DUSP3 (0.42) CASP3TTRCES1MEN1KMT2A
SCHEMBL19848946 0.85 CASP3 (0.43) CASP3TTRCES1MEN1KMT2A
SCHEMBL19848805 0.85 KIF11 (0.44) CASP3MEN1KMT2AMAPT
SCHEMBL19848837 0.85 KIF11 (0.50) CASP3MEN1KMT2AMAPT
SCHEMBL19848949 0.85 CASP3 (0.43) CASP3TTRCES1MEN1KMT2A
SCHEMBL23515987 0.85 DUSP3 (0.42) CASP3TTRCES1MEN1KMT2A
SCHEMBL19848955 0.85 CA1 (0.38) CASP3TTRCES1MEN1KMT2A
SCHEMBL23515907 0.85 DUSP3 (0.42) CASP3TTRCES1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9917270-B1 Organic electroluminescent device having an exciton quenching layer CYNORA GMBH (DE) 2018-03-13 — — US disclosed
US-9917270-B1 Organic electroluminescent device having an exciton quenching layer CYNORA GMBH (DE) 2018-03-13 — — US disclosed
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