Cyclohexane

Cyclohexane

SCHEMBL3670822

C1CCCCC1.CC1CCCC1

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
KMT2A Q03164 1/20 0.43
EPHX1 P07099 1/20 0.42
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.35
CA12 O43570 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
SHBG P04278 1/20 0.33

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
SCHEMBL3675505 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
SCHEMBL14026664 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
SCHEMBL802 1.00
SCHEMBL5189 1.00
SCHEMBL9256078 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
Cycloheptane SCHEMBL23885013 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
SCHEMBL7912061 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
SCHEMBL15121491 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
SCHEMBL9791506 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2
SCHEMBL866985 1.00 ACHE (0.43) ACHEKMT2AEPHX1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4655484-A DISTILLATION WITH ISOMERIZATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1987-04-07 US claimed
US-4654452-A HEXANES STREAM, METHYLCYCLOPENTANE TO CYCLOHEXANE PHILLIPS PETROLEUM COMPANY (US) 1987-03-31 US claimed
CN-111356704-A Toluene-free silica-supported single-site metallocene catalysts from in situ formation of supported MAO in aliphatic solvents 埃克森美孚化学专利公司 2020-06-30 CN disclosed
CN-109293465-A A kind of technique of the separation of single column heat pump distillation methyl cyclopentane and hexamethylene 青岛科技大学 2019-02-01 CN disclosed
US-20100069588-A1 PROCESS FOR PRODUCTION OF SYNDIOTACTIC PROPYLENE POLYMER Mitsuri Chemicals Inc. 2010-03-18 US disclosed
EP-2083023-A1 METHOD FOR PRODUCING SYNDIOTACTIC PROPYLENE POLYMER Mitsui Chemicals, Inc. (JP) 2009-07-29 EP disclosed
EP-1623822-A1 LAMINATE CONTAINING HYDROGENATED COPOLYMER Asahi Kasei Chemicals Corporation (JP) 2006-02-08 EP disclosed
EP-0353813-B1 Alkylation of aromatic hydrocarbons in a fixed bed catalytic process PETROQUIMICA ESPANOLA S A PETR (ES) 1995-12-13 EP disclosed
US-5157158-A Continuous alkylation of an aromatic alcohol using a zeolite or clay alkylation catalyst PETROQUIMICA ESPANOLA, S.A. PETRESA (ES) 1992-10-20 US disclosed
US-5146026-A To produce biodegradable detergents PETROQUIMICA ESPANOLA, S.A. PETRESA (ES) 1992-09-08 US disclosed
EP-0353813-A1 Alkylation of aromatic hydrocarbons in a fixed bed catalytic process PETROQUIMICA ESPANOLA, S.A. PETRESA (ES) 1990-02-07 EP disclosed
US-4014948-A ALUMINA CATALYSTS ACTIVATED WITH HYDROGEN HALIDEHALOSILANEORGANIC HALIDE PHILLIPS PETROLEUM COMPANY (US) 1977-03-29 US disclosed
US-4008288-A ALUMINA CATALYST ACTIVATED AND COOLED WITH HCLHYDROGEN CHLORIDE PHILLIPS PETROLEUM COMPANY (US) 1977-02-15 US disclosed
US-3993594-A ALUMINA CATALYSTS WITH HALOSILANEFOR ISOMERIZATION OF FEEDSTOCKS PHILLIPS PETROLEUM COMPANY (US) 1976-11-23 US disclosed
US-3992467-A Process for alkylating aromatic hydrocarbons and catalyst therefor NL INDUSTRIES, INC. (US) 1976-11-16 US disclosed
US-3979333-A ALUMINA CATALYSTS WITH HYDROGEN HALIDEHALOSILANEORGANIC HALIDE PHILLIPS PETROLEUM COMPANY (US) 1976-09-07 US disclosed
US-3979331-A ION-EXCHANGED HECTORITE CLAY NL INDUSTRIES, INC. (US) 1976-09-07 US disclosed
US-3970589-A ALUMINA CATALYST WITH HCLHYDROGEN CHLORIDE PHILLIPS PETROLEUM COMPANY (US) 1976-07-20 US disclosed
US-3965043-A Catalyst for alkylating aromatic hydrocarbons therefor NL INDUSTRIES, INC. (US) 1976-06-22 US disclosed
US-3962361-A ION-EXCHANGED SAPONITA AS CATALYST NL INDUSTRIES, INC. (US) 1976-06-08 US disclosed