SCHEMBL3313743

SCHEMBL3313743

CCCCCCCCCCCCN1CNCNC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 8/20 0.46
GNAI3 P08754 7/20 0.46
GNAI1 P63096 7/20 0.46
GUSB P08236 2/20 0.44
EBP Q15125 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
GBA1 P04062 1/20 0.37
SOD3 P08294 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL8751413 1.00 GNAO1 (0.46) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL3310643 1.00 GNAO1 (0.46) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL20418301 0.98 GNAO1 (0.43) GNAO1GNAI3GNAI1GUSBEBP
Hydrochloric Acid SCHEMBL27558043 0.96 GNAO1 (0.43) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL27558042 0.92 GNAO1 (0.41) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL6557162 0.91 GLB1 (0.40) GNAO1GNAI3GNAI1GUSBEBP
Propene SCHEMBL28313374 0.88 GNAO1 (0.38) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL18236400 0.82 GNAO1 (0.46) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL11681717 0.80
SCHEMBL8582471 0.79 TSHR (0.39) GNAO1GNAI3GNAI1SIGMAR1ALDH1A1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160333288-A1 Cyclen Friction Modifiers for Boundary Lubrication UNITED STATES DEPARTMENT OF ENERGY 2016-11-17 US disclosed
WO-2016183207-A1 CYCLEN FRICTION MODIFIERS FOR BOUNDARY LUBRICATION NORTHWESTERN UNIVERSITY (US) 2016-11-17 WO disclosed
CN-101065410-B Catalyst system for olefin polymerization, its preparation and use BASELL POLYOLEFINE GMBH 2010-10-13 CN disclosed
US-20100107476-A1 Compositions and Methods Including Hexahydrotriazines Useful as Direct Injection Fuel Additives AFTON CHEMICAL CORPORATION (US) 2010-05-06 US disclosed
CN-100528914-C Preparation of supported cocatalyst BASELL POLYOLEFINE GMBH (DE) 2009-08-19 CN disclosed
CN-101065410-A Catalyst system for olefin polymerization, its preparation and use BASELL POLYOLEFINE GMBH (DE) 2007-10-31 CN disclosed
CN-100334098-C New monocyclopentadienyl complex BASELL POLYOLEFINE GMBH (DE) 2007-08-29 CN disclosed
CN-1922217-A Preparation of supported cocatalysts BASELL POLYOLEFINE GMBH (DE) 2007-02-28 CN disclosed
CN-1894267-A Monocyclopentadienyl complexes BASELL POLYOLEFINE GMBH (DE) 2007-01-10 CN disclosed
CN-1260256-C Catalyst solid comprising pyrogenic silica for olefin polymerization BASELL POLYOLEFINE GMBH (DE) 2006-06-21 CN disclosed
CN-1227257-C Oligomerisation catalyst BASF AG (DE) 2005-11-16 CN disclosed
CN-1688594-A New monocyclopentadienyl complex BASELL POLYOLEFINE GMBH (DE) 2005-10-26 CN disclosed
CN-1195780-C Catalytic solid supported on calcined hydrotalcite for olefine polymerisation BASELL POLYOLEFINE GMBH (DE) 2005-04-06 CN disclosed
CN-1604914-A Catalyst solid comprising pyrogenic silica for olefin polymerization BASELL POLYOLEFINE GMBH (DE) 2005-04-06 CN disclosed
CN-1168745-C Method for polymerising olefins BASF 2004-09-29 CN disclosed
CN-1436199-A Catalytic solid supported on calcined hydrotalcite for olefine polymerisation BASELL POLYOLEFINE GMBH (DE) 2003-08-13 CN disclosed
CN-1353724-A Method for polymerization of olefin BASF AG (DE) 2002-06-12 CN disclosed
CN-1353723-A Method for polymerising olefins BASF AG (DE) 2002-06-12 CN disclosed
CN-1348458-A Oligomerization catalyst BASF AG (DE) 2002-05-08 CN disclosed