SCHEMBL19850803

SCHEMBL19850803

CN1C(=O)c2cccc(-n3c4ccccc4c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c43)c2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DUSP3 P51452 1/20 0.39
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ USP2 O75604 3/20 0.36
▸ KEAP1 Q14145 2/20 0.36
▸ NFE2L2 Q16236 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CASP3 P42574 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ TTR P02766 1/20 0.35
▸ CES1 P23141 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ BRCA1 P38398 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ADK P55263 1/20 0.35

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
SCHEMBL19850800 0.94 MEN1 (0.39) MEN1KMT2AUSP2KEAP1NFE2L2
SCHEMBL19850804 0.93 DUSP3 (0.42) DUSP3MEN1KMT2AUSP2KEAP1
SCHEMBL19850802 0.86 CASP3 (0.42) MEN1KMT2AUSP2KEAP1NFE2L2
SCHEMBL23516506 0.85 MAPK14 (0.45) DUSP3MAPTBRD4CCKBR
SCHEMBL19848962 0.85 ADK (0.45) DUSP3MEN1KMT2AUSP2KEAP1
SCHEMBL19850914 0.85 HSPA1A (0.45) DUSP3MEN1KMT2AUSP2KEAP1
SCHEMBL23515987 0.85 DUSP3 (0.42) DUSP3MEN1KMT2AUSP2KEAP1
SCHEMBL23515907 0.85 DUSP3 (0.42) DUSP3MEN1KMT2AUSP2KEAP1
SCHEMBL19848897 0.84 TRPA1 (0.38) DUSP3MEN1KMT2AUSP2KEAP1
SCHEMBL19852606 0.84 BRD4 (0.38) DUSP3MEN1KMT2AUSP2KEAP1

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
EP-3494113-B1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-10-06 — — EP disclosed
WO-2018024724-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-08 — — WO disclosed
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