SCHEMBL21702834

SCHEMBL21702834

c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2S32c3ccccc3N(c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c3ccccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE6D O43924 1/20 0.37
▸ MEN1 O00255 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ MAPT P10636 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ FAAH O00519 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ APAF1 O14727 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ PTBP1 P26599 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ GALK1 P51570 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ SMAD3 P84022 1/20 0.33

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
SCHEMBL22484956 0.83 PDE6D (0.38) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL22871622 0.82 L3MBTL1 (0.35) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL22522876 0.82 L3MBTL1 (0.37) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL16449655 0.76 L3MBTL1 (0.48) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL30409979 0.76 L3MBTL1 (0.48) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL19071919 0.76 MEN1 (0.33) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL16884748 0.75 PDE6D (0.40) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL16884807 0.75 PDE6D (0.43) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL16271062 0.75 L3MBTL1 (0.47) PDE6DMEN1KMT2AMAPTALDH1A1
SCHEMBL16449665 0.75 L3MBTL1 (0.47) PDE6DMEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200052226-A1 Organic Light Emitting Diode and Organic Light Emitting Device Having the Same LG DISPLAY CO., LTD. (KR) 2020-02-13 — — US disclosed
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