SCHEMBL9337064

SCHEMBL9337064

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

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
PTGES2 Q9H7Z7 1/20 0.38
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
MAOA P21397 1/20 0.35
KCNH2 Q12809 1/20 0.35
CETP P11597 1/20 0.35
TSHR P16473 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
SCHEMBL9337081 1.00 MAOB (0.39) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9336876 0.96 MAOB (0.36) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9336895 0.96 MAOB (0.36) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9337351 0.91 MAOB (0.39) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9337364 0.91 MAOB (0.39) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL7911089 0.91 TSHR (0.43) MAOBMAOAKCNH2TSHR
SCHEMBL9340323 0.89 CETP (0.39) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9340314 0.89 CETP (0.39) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9336656 0.88 MAOB (0.36) MAOBPTGES2HCRTR1HCRTR2MAOA
SCHEMBL9340916 0.88 CETP (0.38) MAOBPTGES2HCRTR1HCRTR2MAOA

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 5 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
EP-0313604-A1 ELECTRO-OPTICAL LIQUID CRYSTAL DISPLAY ELEMENT. MERCK PATENT GMBH (DE) 1989-05-03 EP disclosed
WO-1988008441-A1 ELECTRO-OPTICAL LIQUID CRYSTAL DISPLAY ELEMENT MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1988-11-03 WO disclosed