SCHEMBL4799528

SCHEMBL4799528

CCCC1CCC(CCc2ccc(C#N)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.57
MAOA P21397 2/20 0.57
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CYP2A6 P11509 1/20 0.48
HRH3 Q9Y5N1 3/20 0.45
KCNJ1 P48048 1/20 0.45
KCNH2 Q12809 1/20 0.45
LOXL2 Q9Y4K0 2/20 0.42
CYP19A1 P11511 1/20 0.38
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
CTSC P53634 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL4799521 1.00 MAOB (0.57) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL10479842 0.98 MAOB (0.56) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL10479938 0.98 MAOB (0.56) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL10833394 0.98 MAOB (0.56) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL5351747 0.95 MAOB (0.53) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL10802955 0.95 TSHR (0.56) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL5351751 0.95 MAOB (0.53) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL10802960 0.95 TSHR (0.56) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL5351741 0.95 MAOB (0.53) MAOBMAOATSHRHSD17B10CYP2A6
SCHEMBL9317223 0.91 TSHR (0.52) MAOBMAOATSHRHSD17B10CYP2A6

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7445818-B2 Matrix liquid crystal display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-11-04 US disclosed
US-20070275182-A1 Matrix liquid crystal display WEBER GEORG 2007-11-29 US disclosed
US-7186447-B2 Two plane parallel support plates with frame form cell, with integrated non-linear elements for switching individual picture elements on support plates, and nematic liquid crystal mixture is present in cell, having positive dielectric anisotropy and high resistivity MERCK PATENT GMBH (DE) 2007-03-06 US disclosed
US-20050196551-A1 Matrix liquid crystal display WEBER GEORG (DE) 2005-09-08 US disclosed
US-6905740-B2 The invention relates to a matrix liquid crystal display containing integrated non-linear elements and a liquid crystal mixture which has a particularly high resistivity. MERCK PATENT GMBH (DE) 2005-06-14 US disclosed
US-20030207046-A1 Matrix liquid crystal display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2003-11-06 US disclosed
US-6562419-B1 Matrix liquid crystal display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2003-05-13 US disclosed
US-6210760-B1 SHORT SWITCHING TIMES AND GRADIENTS AND ANGULAR DEPENDENCIES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2001-04-03 US disclosed
US-6004479-A FLUOROETHERS FOR LIQUID CRYSTAL DISPLAYS AND DIELECTRICS MERCK KGAA (DE) 1999-12-21 US disclosed
EP-0394417-B2 SUPERTWIST LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 1999-08-04 EP disclosed
US-4882082-A PYRIMIDINE DERIVATIVE LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-11-21 US disclosed
EP-0338059-A1 IMPROVED LIQUID CRYSTAL MIXTURE CASIO COMPUTER COMPANY LIMITED (JP) 1989-10-25 EP disclosed
WO-1989008692-A1 SUPERTWIST LIQUID CRYSTAL DISPLAY MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 WO disclosed
EP-0317587-A1 LIQUID CRYSTAL PHASE. MERCK PATENT GMBH (DE) 1989-05-31 EP disclosed
WO-1989003867-A1 IMPROVED LIQUID CRYSTAL MIXTURE CASIO COMPUTER COMPANY LIMITED (JP) 1989-05-05 WO disclosed
WO-1988009360-A1 LIQUID CRYSTAL PHASE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1988-12-01 WO disclosed
US-4752414-A LIQUID CRYSTAL PHASES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-06-21 US disclosed
EP-0152808-A2 Nitrogen containing heterocycles MERCK PATENT GmbH (DE) 1985-08-28 EP disclosed
US-4391731-A Hydrogenated naphthalenes HOFFMANN-LA ROCHE INC. (US) 1983-07-05 US disclosed
EP-0047817-A2 Hydrogenated naphthalines, their preparation and application, and mixtures containing such naphthalines F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1982-03-24 EP disclosed