SCHEMBL2829356

SCHEMBL2829356

CCCC1CC/C=C\CCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
FYN P06241 1/20 0.32
CYP2C9 P11712 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
CHRNA7 P36544 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2829357 1.00 CYP1A2 (0.43) CYP1A2FYNCYP2C9CA1CA2
SCHEMBL24438291 1.00 CYP1A2 (0.43) CYP1A2FYNCYP2C9CA1CA2
SCHEMBL7980529 0.91 CYP1A2 (0.39) CYP1A2FYNCYP2C9CA1CA2
SCHEMBL16567992 0.87 CYP1A2 (0.61) CYP1A2NOS1NOS2LMNAMAPT
SCHEMBL7994838 0.87 CYP1A2 (0.61) CYP1A2NOS1NOS2LMNAMAPT
SCHEMBL7992355 0.84 CYP1A2 (0.37) CYP1A2FYNCA1CA2CA4
SCHEMBL17941536 0.84 CYP1A2 (0.52) CYP1A2ALDH1A1LMNAMAPTMEN1
SCHEMBL17941530 0.84 CYP1A2 (0.52) CYP1A2ALDH1A1LMNAMAPTMEN1
SCHEMBL150807 0.82 CYP1A2 (0.43) CYP1A2FYNCYP2C9CA1CA2
SCHEMBL147319 0.81 CYP1A2 (0.46) CYP1A2FYNCYP2C9CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0152918-A1 Olefin conversion PHILLIPS PETROLEUM COMPANY (US) 1985-08-28 EP claimed
US-3995095-A Modification of polymers by treatment with olefins PHILLIPS PETROLEUM COMPANY (US) 1976-11-30 US claimed
EP-2194034-A1 Disproportionation process SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2010-06-09 EP disclosed
EP-1648943-B1 REMOVING GELLED UNSATURATED ELASTOMERS FROM POLYMERIZATION EQUIPMENT ASSOCIATED WITH THEIR PRODUCTION FIRESTONE POLYMERS LLC (US) 2010-03-31 EP disclosed
US-7132503-B2 Removing gelled unsaturated elastomers from polymerization equipment associated with their production BRIDGESTONE CORPORATION (JP) 2006-11-07 US disclosed
US-20050026797-A1 Removing gelled unsaturated elastomers from polymerization equipment associated with their production FIRESTONE POLYMERS, LLC 2005-02-03 US disclosed
US-5446102-A Decreasing molecular weight of unsaturated polymers BRIDGESTON, CORPORATION (JP) 1995-08-29 US disclosed
US-5254786-A Contacting with supported molybdenum or rhenium catalyst promoted with an organoborane compound SHELL OIL COMPANY (US) 1993-10-19 US disclosed
US-5210365-A Molybdenum or rhenium oxide on oxide support SHELL OIL COMPANY (US) 1993-05-11 US disclosed
US-5114899-A Molybdenum and/or rhenium supported on oxide and promoted with silane and/or disilane compound SHELL OIL COMPANY (US) 1992-05-19 US disclosed
US-5098876-A A molybdenum-rhenium oxide catalyst with an organoboron promoter for disproportionation reactions SHELL OIL COMPANY (US) 1992-03-24 US disclosed
US-4454368-A RHENIUM OXIDE AND ALUMINUM ALKYL CATALYST ON REFRACTORY OXIDE PHILLIPS PETROLEUM COMPANY (US) 1984-06-12 US disclosed
US-4287378-A BY CATALYTIC DISPROPORTIONATION, PROPORTIONATION, OR ISOMERIZATION WHEREIN THE CATALYST IS A TRANSITION METAL OXIDE EXPOSED TO RADIATION PHILLIPS PETROLEUM COMPANY (US) 1981-09-01 US disclosed
US-4126577-A COMPOUND OF VANADIUM OR NIOBIUM COMPLEXED WITH NITRIC OXIDE AND A SELECTED COMPLEXING AGENT PHILLIPS PETROLEUM COMPANY (US) 1978-11-21 US disclosed
US-4071471-A MAGNESIUM OXIDE AND AN OLEFIN DISPROPORTIONATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1978-01-31 US disclosed
US-4010217-A NITROSYL MOLYBDENUM OR TUNGSTEN COORDINATION CATALYST, ORGANOALUMINUM ADJUVANT PHILLIPS PETROLEUM COMPANY (US) 1977-03-01 US disclosed
US-3996166-A Catalysts for conversion of olefins PHILLIPS PETROLEUM COMPANY (US) 1976-12-07 US disclosed
US-3995095-A Modification of polymers by treatment with olefins PHILLIPS PETROLEUM COMPANY (US) 1976-11-30 US disclosed
US-3974100-A MOLYBDENUM OXIDE, RHENIUM OXIDE PHILLIPS PETROLEUM COMPANY (US) 1976-08-10 US disclosed
US-3952070-A TUNGSTEN OXIDE ON SILICA CATALYST THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-04-20 US disclosed