SCHEMBL22679459

SCHEMBL22679459

c1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5cccc6c5ccc5c6c6cccc7c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc8n5c76)cc5c6c7ccccc7ccc6n4c35)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.35
PLA2G4A P47712 3/20 0.35
PLA2G10 O15496 1/20 0.34
ABCG2 Q9UNQ0 4/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1A2 P05177 1/20 0.34
FYN P06241 1/20 0.34
MAPK3 P27361 1/20 0.34
AHR P35869 1/20 0.34
PAX8 Q06710 1/20 0.34
PRKDC P78527 3/20 0.32
KDM4E B2RXH2 3/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 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
SCHEMBL21710584 0.92 PRKDC (0.38) PLA2G2APLA2G4AABCG2CYP1A1CYP1A2
SCHEMBL22858088 0.89 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ABCG2CYP1A1
SCHEMBL21718135 0.83 ALOX5 (0.41) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL21710471 0.83 NPC1 (0.36) PLA2G2APLA2G4AABCG2CYP1A1CYP1A2
SCHEMBL21710486 0.83 NTSR1 (0.32) CA12CA1CA2CA9
SCHEMBL21717836 0.83 CHRNA1 (0.32) CYP1A2CA12CA1CA2CA9
SCHEMBL22858105 0.82 PTGES (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL21718134 0.82 PTGES (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL22858086 0.81 PTGES (0.35) PLA2G2APLA2G4APLA2G10ABCG2CYP1A1
SCHEMBL20465299 0.80 TDP1 (0.37) ABCG2CYP1A1CYP1A2FYNMAPK3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11723272-B2 Organic electroluminescence element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-08-08 US disclosed
US-20200365812-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-11-19 US disclosed