SCHEMBL22061718

SCHEMBL22061718

Clc1ccc2oc3c(-c4cc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccccc5)n4)cccc3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.44
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ CTRC Q99895 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ AHR P35869 1/20 0.40
▸ PIM1 P11309 2/20 0.40
▸ CSNK2A2 P19784 2/20 0.40
▸ CSNK2B P67870 2/20 0.40
▸ PIM3 Q86V86 2/20 0.40
▸ PIM2 Q9P1W9 2/20 0.40

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 0.98 MAOB (0.43) MAOBMEN1KMT2AALDH1A1MAPT
SCHEMBL22060932 0.92 NPSR1 (0.42) MAOBMEN1KMT2AALDH1A1MAPT
SCHEMBL22061611 0.91 ADORA3 (0.43) MEN1KMT2AALDH1A1LMNAMAPK1
SCHEMBL22061622 0.90 MAPK1 (0.47) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL23248740 0.90 AHR (0.45) MAOBMEN1KMT2AALDH1A1MAPT
SCHEMBL25019023 0.89 KMT2A (0.46) MAOBMEN1KMT2AALDH1A1MAPT
SCHEMBL22061615 0.89 KMT2A (0.43) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22888687 0.88 ALOX5 (0.50) MAOBMEN1KMT2AALDH1A1MAPT
SCHEMBL31637208 0.88 ALOX5 (0.43) MAOBMEN1KMT2AALDH1A1MAPT
SCHEMBL26690084 0.87 KMT2A (0.40) MAOBMEN1KMT2AALDH1A1MAPT

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
WO-2020111663-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-04 — — WO disclosed
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