SCHEMBL23311535

SCHEMBL23311535

c1ccc2c(c1)oc1ccc(-c3nc(-c4ccc(C56CC7C[C@H](C5)C[C@@H](C7)C6)cc4)nc(-c4cccc5c4oc4ccccc4c4ccccc4c4ccccc54)n3)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.39
▸ HTT P42858 1/20 0.37
▸ ALDH1A1 P00352 6/20 0.35
▸ LMNA P02545 5/20 0.35
▸ MAPT P10636 4/20 0.35
▸ TSHR P16473 3/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ STS P08842 1/20 0.34
▸ PRKDC P78527 3/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ CHEK2 O96017 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MEN1 O00255 2/20 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
SCHEMBL26271511 0.94 HTT (0.40) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271518 0.94 ALOX5 (0.40) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271755 0.94 ALOX5 (0.40) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26272359 0.94 ALOX5 (0.41) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271717 0.93 ALOX5 (0.37) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271495 0.93 ALOX5 (0.40) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271566 0.93 ALOX5 (0.40) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271532 0.93 ALOX5 (0.43) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271769 0.92 ALOX5 (0.39) ALOX5HTTALDH1A1LMNAMAPT
SCHEMBL26271747 0.92 ALOX5 (0.36) ALOX5HTTALDH1A1LMNAMAPT

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-2021080253-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-04-29 — — WO disclosed
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