SCHEMBL22057994

SCHEMBL22057994

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5oc6ccccc6c5c4)c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.42
▸ HPGD P15428 5/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CHEK2 O96017 1/20 0.41
▸ PLA2G2A P14555 3/20 0.40
▸ PLA2G4A P47712 3/20 0.40
▸ AHR P35869 1/20 0.39
▸ PLA2G10 O15496 1/20 0.39
▸ TSHR P16473 3/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ HSP90AA1 P07900 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
SCHEMBL22058002 0.99 PLA2G2A (0.43) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL15501614 0.97 PLA2G2A (0.45) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL21563807 0.94 MAPT (0.42) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL23385227 0.94 MAPT (0.42) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL23027581 0.93 MAPT (0.40) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL23027574 0.93 MAPT (0.40) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL23385055 0.93 PLA2G2A (0.43) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL22058840 0.93 PLA2G2A (0.42) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL23027611 0.92 PLA2G2A (0.40) MAPTHPGDALDH1A1KMT2AMEN1
SCHEMBL23027670 0.92 MAPT (0.39) MAPTHPGDALDH1A1KMT2AMEN1

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-2020111585-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-06-04 — — WO disclosed
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