SCHEMBL22061622

SCHEMBL22061622

Clc1ccc2oc3c(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)cccc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.47
▸ AHR P35869 2/20 0.43
▸ AURKA O14965 1/20 0.43
▸ AURKB Q96GD4 1/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ ADORA3 P0DMS8 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ TNKS O95271 1/20 0.43
▸ PIM1 P11309 1/20 0.42
▸ CSNK2A2 P19784 1/20 0.42
▸ CSNK2B P67870 1/20 0.42
▸ PIM3 Q86V86 1/20 0.42
▸ PIM2 Q9P1W9 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41

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
SCHEMBL22061235 0.93 MAOB (0.43) MAPK1AHRAURKAAURKBKMT2A
SCHEMBL20754057 0.91 AHR (0.44) MAPK1AHRKMT2AADORA3KDM4E
SCHEMBL22061718 0.90 MAOB (0.44) MAPK1AHRAURKAAURKBKMT2A
SCHEMBL22118134 0.90 ALOX5 (0.48) MAPK1AHRAURKAAURKBKMT2A
SCHEMBL22061689 0.89 ALOX5 (0.44) MAPK1AHRKMT2AADORA3KDM4E
SCHEMBL22061615 0.89 KMT2A (0.43) MAPK1AHRKMT2AADORA3KDM4E
SCHEMBL21811018 0.88 AHR (0.51) AHRKMT2AADORA3KDM4ETNKS
SCHEMBL22061611 0.88 ADORA3 (0.43) MAPK1AHRAURKAAURKBKMT2A
SCHEMBL24216877 0.87 PIM1 (0.44) MAPK1KMT2AKDM4EPIM1CSNK2A2
SCHEMBL24217376 0.87 PIM1 (0.44) MAPK1KMT2AKDM4EPIM1CSNK2A2

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
US-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 — — US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 — — US disclosed
WO-2020111663-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-04 — — WO disclosed
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