SCHEMBL19850280

SCHEMBL19850280

N#Cc1ccc2c3ccccc3n(-c3cccc4c3C(=O)N(c3cccc(-c5ccccc5)c3)C4O)c2c1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ G6PD P11413 2/20 0.33
▸ HDAC8 Q9BY41 2/20 0.33
▸ HDAC6 Q9UBN7 2/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ FASN P49327 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ TDP2 O95551 2/20 0.31
▸ DPP4 P27487 2/20 0.31
▸ PTGES O14684 1/20 0.31
▸ FAAH O00519 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ MGLL Q99685 1/20 0.31
▸ PTGDR2 Q9Y5Y4 1/20 0.31

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
SCHEMBL19850281 0.97 G6PD (0.34) G6PDHDAC8HDAC6FASNTDP2
SCHEMBL19843398 0.93 ATM (0.35) G6PDKMT2AFASNTDP2PTGES
SCHEMBL19850147 0.92 KMT2A (0.33) KMT2APTGESFAAHALDH1A1HSP90AA1
SCHEMBL24282901 0.92 FFAR2 (0.36) PTGES
SCHEMBL19842591 0.92 FASN (0.35) G6PDKMT2AFASNTDP2DPP4
SCHEMBL19850175 0.91 FFAR2 (0.35) KMT2APTGESALDH1A1
SCHEMBL19850153 0.91 MEN1 (0.35) KMT2AATM
SCHEMBL19842383 0.91 TDP2 (0.35) G6PDHDAC8HDAC6FASNTDP2
SCHEMBL24283023 0.90 FFAR2 (0.35) PTGESALDH1A1
SCHEMBL19850089 0.90 KMT2A (0.36) KMT2AFAAHALDH1A1HSP90AA1PKM

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-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
WO-2018024725-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-08 — — WO disclosed
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