SCHEMBL13935870

SCHEMBL13935870

Clc1cc2c(oc3cccc4c3c2c2cccc3oc5c6ccccc6c(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc5c4c32)c2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 8/20 0.39
▸ ALOX5 P09917 2/20 0.35
▸ TTR P02766 1/20 0.33
▸ PLA2G2A P14555 1/20 0.33
▸ PLA2G4A P47712 1/20 0.33
▸ GABRP O00591 1/20 0.32
▸ GABRD O14764 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRB1 P18505 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 1/20 0.32
▸ GABRA3 P34903 1/20 0.32
▸ GABRA2 P47869 1/20 0.32
▸ GABRB2 P47870 1/20 0.32
▸ GABRA4 P48169 1/20 0.32
▸ GABRE P78334 1/20 0.32
▸ GABRA6 Q16445 1/20 0.32
▸ GABRG1 Q8N1C3 1/20 0.32
▸ GABRG3 Q99928 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
SCHEMBL13935844 0.93 AHR (0.42) AHRALOX5TTRGABRPGABRD
SCHEMBL13935846 0.86 AHR (0.50) AHRALOX5TTR
SCHEMBL13935848 0.84 ALOX5 (0.43) ALOX5PLA2G2APLA2G4AGABRPGABRD
SCHEMBL13935802 0.84 ALOX5 (0.42) ALOX5GABRPGABRDGABRA1GABRB1
SCHEMBL13935862 0.82 ALOX5 (0.37) AHRALOX5PLA2G2APLA2G4AGABRP
SCHEMBL24672286 0.81 AHR (0.45) AHRALOX5TTRPLA2G2APLA2G4A
SCHEMBL22818311 0.80 AHR (0.47) AHRALOX5TTRGABRPGABRD
SCHEMBL31597560 0.80 AHR (0.47) AHRALOX5TTRGABRPGABRD
SCHEMBL13935853 0.80 CDC14B (0.43) AHRALOX5PLA2G2APLA2G4AGABRP
SCHEMBL16574380 0.79 AHR (0.41) AHRALOX5PLA2G2APLA2G4AGABRP

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-7494721-B2 Light-emitting device, condensed polycyclic compound used therein and method for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-24 — — US disclosed
US-7494721-B2 Light-emitting device, condensed polycyclic compound used therein and method for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-24 — — US disclosed
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