SCHEMBL25957362

SCHEMBL25957362

c1ccc(-c2cc(-c3cccc(-c4ccc(-c5ccc(-c6c7ccccc7c(-c7cc(-c8ccccc8)c8oc9ccccc9c8c7)c7ccccc67)cc5)cc4)c3)c3oc4ccc(-c5c6ccccc6c(-c6cccc(-c7ccc(-c8c(-c9ccccc9)ccc9c8oc8ccc(-c%10c%11ccccc%11c(-c%11ccc(-c%12cccc%13ccccc%12%13)cc%11)c%11ccccc%10%11)cc89)cc7)c6)c6ccccc56)cc4c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.39
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ PLA2G2A P14555 3/20 0.34
▸ PLA2G4A P47712 3/20 0.34
▸ PLA2G10 O15496 1/20 0.34
▸ PRKDC P78527 2/20 0.33
▸ GGPS1 O95749 1/20 0.33
▸ PIM1 P11309 1/20 0.32
▸ CSNK2A2 P19784 1/20 0.32
▸ CSNK2B P67870 1/20 0.32
▸ PIM3 Q86V86 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ PTGES2 Q9H7Z7 1/20 0.32
▸ EDNRB P24530 1/20 0.31
▸ EDNRA P25101 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ ACMSD Q8TDX5 1/20 0.31

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
SCHEMBL23094347 0.90 ALOX5 (0.41) ALOX5CA12CA1CA2CA9
SCHEMBL24772319 0.89 ALOX5 (0.42) ALOX5CA12CA1CA2CA9
SCHEMBL24178701 0.88 ALOX5 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL25591406 0.87 ALOX5 (0.41) ALOX5PLA2G2APLA2G4APLA2G10PRKDC
SCHEMBL24710377 0.87 ALOX5 (0.40) ALOX5CA12CA1CA2CA9
SCHEMBL22706921 0.87 ALOX5 (0.41) ALOX5CA12CA1CA2CA9
SCHEMBL10122415 0.87 ALOX5 (0.45) ALOX5CA12CA1CA2CA9
SCHEMBL26404309 0.87 ALOX5 (0.44) ALOX5CA12CA1CA2CA9
SCHEMBL24771720 0.87 ALOX5 (0.44) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL10122430 0.86 ALOX5 (0.43) ALOX5CA12CA1CA2CA9

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
US-20230232650-A1 ORGANOELECTROLUMINESCENT DEVICE USING POLYCYCLIC AROMATIC COMPOUNDS SFC CO., LTD (KR) 2023-07-20 — — US disclosed
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