Cyclohexene

Cyclohexene

SCHEMBL1999560

C1=CCCCC1.CC(C)=O

nearest known ligand 0.43

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.31
THPO P40225 1/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31

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
Cyclopentene SCHEMBL9151969 0.93
Cyclohexene SCHEMBL23409884 0.90 FFAR3 (0.47) LMNAFFAR3LCKFYN
Cyclohexene SCHEMBL3138151 0.90 FFAR3 (0.47) LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL27952408 0.87 FFAR3 (0.44) FFAR3LCKFYN
Cyclohexene SCHEMBL7152357 0.87 FFAR3 (0.44) FFAR3LCKFYN
Acetic Acid SCHEMBL4983986 0.87 FFAR3 (0.44) FFAR3LCKFYN
Acetic Acid SCHEMBL29062607 0.87 FFAR3 (0.44) FFAR3LCKFYN
Acetic Acid SCHEMBL4983972 0.87 FFAR3 (0.44) FFAR3LCKFYN
Acetone SCHEMBL28142527 0.84 LMNA (0.35) LMNA
Cyclopentene SCHEMBL1523429 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102105435-B 5-isopropyl-3-aminomethyl-2-methyl-1-amino-cyclohexane (carvone diamine), and method for the production thereof BASF SE 2014-07-23 CN disclosed
EP-1857471-B1 POLYMERIZATION CATALYST COMPOSITION AND PROCESS FOR PRODUCTION OF POLYMER MITSUI CHEMICALS INC (JP) 2013-04-24 EP disclosed
CN-102105435-A 5-isopropyl-3-aminomethyl-2-methyl-1-amino-cyclohexane (carvone diamine), and method for the production thereof BASF SE 2011-06-22 CN disclosed
US-7960305-B2 a mixture of a phosphazenium compound such as tetrakis[tris(dimethylamino)phosphoranylideneamino]phosphonium chloride, transition metal halides and an organic halogen compound as an activator, used for addition homo/copolymerization; living polymers MITSUI CHEMICALS, INC. (JP) 2011-06-14 US disclosed
US-20080177014-A1 Polymerization Catalyst Composition and Process for Production of Polymer MITSUI CHEMICALS, INC. (JP) 2008-07-24 US disclosed
EP-1857471-A1 POLYMERIZATION CATALYST COMPOSITION AND PROCESS FOR PRODUCTION OF POLYMER Mitsui Chemicals, Inc. (JP) 2007-11-21 EP disclosed