SCHEMBL22435726

SCHEMBL22435726

c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc(-c4ccc(-c5ccccc5)c(-c5ccccc5)c4)cc3-c3ccccc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.36
▸ MMP12 P39900 1/20 0.36
▸ MMP13 P45452 1/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ MAPT P10636 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PLA2G2A P14555 4/20 0.35
▸ PLA2G4A P47712 4/20 0.35
▸ THRB P10828 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ PTGER4 P35408 1/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ TNKS O95271 2/20 0.32
▸ NPC1 O15118 3/20 0.32
▸ RAB9A P51151 3/20 0.32

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
SCHEMBL22435719 0.99 MMP12 (0.35) AHRMMP12MMP13MEN1KMT2A
SCHEMBL22435730 0.99 MMP12 (0.35) AHRMMP12MMP13MEN1KMT2A
SCHEMBL22435729 0.96 AHR (0.39) AHRMMP12MMP13MEN1KMT2A
SCHEMBL27270070 0.95 AHR (0.36) AHRMMP12MMP13MEN1KMT2A
SCHEMBL21975868 0.95 AHR (0.38) AHRMMP12MMP13MEN1KMT2A
SCHEMBL22435716 0.95 AHR (0.40) AHRMMP12MMP13MEN1KMT2A
SCHEMBL22435717 0.94 AHR (0.37) AHRMMP12MMP13MEN1KMT2A
SCHEMBL22435718 0.94 PLA2G2A (0.39) AHRMMP12MMP13MEN1KMT2A
SCHEMBL21975869 0.94 AHR (0.37) AHRMMP12MMP13MEN1KMT2A
SCHEMBL21976143 0.94 AHR (0.37) AHRMMP12MMP13MEN1KMT2A

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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