SCHEMBL8072669

SCHEMBL8072669

CCCCCC(C)COc1ccc2cc(C(=O)O)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 3/20 0.54
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.52
THRA P10827 1/20 0.49
RARB P10826 3/20 0.49
KDM4E B2RXH2 1/20 0.49
PTPN11 Q06124 1/20 0.47
PLA2G4A P47712 1/20 0.47

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
SCHEMBL8086481 0.96 PLA2G4B (0.52) PLA2G4BTP53TSHRTHRARARB
SCHEMBL8080346 0.91 KDM4E (0.53) PLA2G4BTP53TSHRKDM4E
SCHEMBL8080261 0.90 RARB (0.52) PLA2G4BTP53TSHRTHRARARB
SCHEMBL8081866 0.88 PLA2G4B (0.64) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL8084886 0.85 MAPK1 (0.56) PLA2G4BTP53TSHRRARBKDM4E
SCHEMBL8086815 0.85 KDM4E (0.55) PLA2G4BKDM4E
SCHEMBL9779552 0.85 KDM4E (0.55) PLA2G4BKDM4E
SCHEMBL8081722 0.84 RARB (0.66) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL8082282 0.84 PLA2G4B (0.62) PLA2G4BTP53TSHRRARBPLA2G4A
SCHEMBL6837189 0.83 TP53 (0.73) PLA2G4BTP53TSHRTHRARARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed