SCHEMBL9340683

SCHEMBL9340683

CCCCCC[C@H]1CC[C@H](CCc2ccc(OC(F)(F)C(F)F)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.38
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
PPARD Q03181 1/20 0.36
MAOB P27338 2/20 0.36
PTGES2 Q9H7Z7 1/20 0.35
FAAH O00519 1/20 0.35
PLG P00747 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
MAOA P21397 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C8 P10632 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL10594632 1.00 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9340690 1.00 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL10594635 1.00 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9336872 1.00 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9336833 1.00 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9340916 0.99 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9340908 0.99 CETP (0.38) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9337022 0.96 CETP (0.36) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9472261 0.96 CETP (0.36) CETPPPARGPPARAITGB3ITGA2B
SCHEMBL9336620 0.96 CETP (0.36) CETPPPARGPPARAITGB3ITGA2B

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
US-5348677-A Electro-optical liquid crystal display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-09-20 US disclosed
US-5196140-A ELECTRO-OPTICAL LIQUID CRYSTAL DISPLAY ELEMENT MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-03-23 US disclosed
EP-0313604-B1 ELECTRO-OPTICAL LIQUID CRYSTAL DISPLAY ELEMENT MERCK PATENT GmbH (DE) 1992-03-25 EP disclosed