SCHEMBL22061220

SCHEMBL22061220

Clc1ccc2oc3c(-c4nc(-c5ccccc5)nc(-c5cccc6oc7ccccc7c56)n4)cccc3c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ AHR P35869 4/20 0.40
▸ ADORA3 P0DMS8 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TNKS O95271 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.39
▸ CSNK2B P67870 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ MAPK1 P28482 1/20 0.38

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
SCHEMBL38666711 0.93 ALOX5 (0.42) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22061689 0.93 ALOX5 (0.44) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL20754057 0.93 AHR (0.44) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22113820 0.92 AHR (0.51) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL29918656 0.92 AHR (0.44) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22329856 0.91 ALOX5 (0.44) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22329825 0.91 ALOX5 (0.44) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22061615 0.91 KMT2A (0.43) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL23822817 0.90 AHR (0.40) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL21926816 0.90 AHR (0.48) KMT2AMAPTMEN1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022086168-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 — — WO disclosed
WO-2021066623-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2021-04-08 — — WO disclosed
WO-2020111663-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-04 — — WO disclosed
Send feedback