SCHEMBL22435701

SCHEMBL22435701

c1ccc(-c2ccccc2-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4c(c3)oc3ccccc34)c(-c3ccccc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.39
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ ALOX5 P09917 1/20 0.37
▸ TNKS O95271 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CA12 O43570 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MMP12 P39900 1/20 0.33
▸ MMP13 P45452 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
SCHEMBL22435717 0.97 AHR (0.37) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435702 0.96 MEN1 (0.36) AHRMEN1KMT2AMAPTHPGD
SCHEMBL27270070 0.94 AHR (0.36) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435716 0.93 AHR (0.40) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435730 0.93 MMP12 (0.35) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435719 0.93 MMP12 (0.35) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435706 0.92 NPC1 (0.39) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435729 0.92 AHR (0.39) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435726 0.91 AHR (0.36) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22435712 0.91 PLA2G2A (0.40) AHRMEN1KMT2AMAPTHPGD

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
WO-2020185054-A9 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 — — WO disclosed
WO-2020185054-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-09-17 — — WO disclosed
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