SCHEMBL19850800

SCHEMBL19850800

CN1C(=O)c2cccc(-n3c4c(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cccc4c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c43)c2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ USP2 O75604 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ KEAP1 Q14145 2/20 0.39
▸ NFE2L2 Q16236 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ CASP3 P42574 2/20 0.39
▸ MAPT P10636 1/20 0.38
▸ TTR P02766 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ CASP1 P29466 1/20 0.37
▸ BRCA1 P38398 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ ADK P55263 1/20 0.37
▸ PRMT1 Q99873 1/20 0.37
▸ GAA P10253 1/20 0.37

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
SCHEMBL19850803 0.94 DUSP3 (0.39) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL19850802 0.92 CASP3 (0.42) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL19850804 0.86 DUSP3 (0.42) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL23516365 0.84 ADK (0.48) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL23516357 0.82 MEN1 (0.40) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL23516341 0.82 TRPA1 (0.40) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL23892895 0.82 TYMS (0.39) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL19850879 0.82 CASP3 (0.39) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL19842471 0.81 PDE6D (0.43) MEN1KMT2AUSP2KDM4EALDH1A1
SCHEMBL23476453 0.81 TYMS (0.41) MEN1KMT2AUSP2KDM4EALDH1A1

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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