SCHEMBL8084709

SCHEMBL8084709

CCCCCC(C)COc1ccc(OC(C)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PLA2G4B P0C869 1/20 0.44
▸ FFAR1 O14842 1/20 0.44
▸ LMNA P02545 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ GPR88 Q9GZN0 8/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TSHR P16473 1/20 0.41

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
SCHEMBL8081223 0.95 FFAR1 (0.45) PLA2G4BFFAR1LMNAGPR88
SCHEMBL8072216 0.89 GPR88 (0.49) FFAR1GPR88
SCHEMBL8081325 0.84 FFAR1 (0.57) FFAR1LMNAGPR88TSHR
SCHEMBL8081866 0.82 PLA2G4B (0.64) PLA2G4BTP53TSHR
SCHEMBL20357815 0.81 CYP3A4 (0.47) PLA2G4BCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL22522160 0.81 SLC2A1 (0.44) GPR88
SCHEMBL8084707 0.80 PLA2G4B (0.58) PLA2G4BFFAR1LMNACYP1A2CYP2D6
SCHEMBL20357889 0.80 RARB (0.46) PLA2G4BCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2406965 0.79 TP53 (0.62) PLA2G4BLMNANPC1CYP1A2CYP3A4
SCHEMBL11658648 0.79 LMNA (0.58) PLA2G4BLMNANPC1CYP1A2CYP3A4

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
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