Butane

Butane

SCHEMBL453103

CCCC.O=C(O)CC(=O)Oc1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.50
CYP19A1 P11511 1/20 0.46
MAPT P10636 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.44
ALOX15 P16050 1/20 0.44
FAAH O00519 6/20 0.43
MEN1 O00255 1/20 0.43
THRB P10828 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.42
ESR1 P03372 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL475526 0.92 CYP19A1 (0.52) ELANECYP19A1MAPTKMT2AALDH1A1
Butane SCHEMBL1043355 0.85 KMT2A (0.47) ELANEMAPTKMT2AALDH1A1LMNA
Butane SCHEMBL1043693 0.85 KMT2A (0.52) ELANEMAPTKMT2AALDH1A1LMNA
Butane SCHEMBL1041531 0.84 KMT2A (0.49) ELANEMAPTKMT2AALDH1A1LMNA
Butane SCHEMBL1041486 0.84 LMNA (0.46) ELANEMAPTKMT2AALDH1A1LMNA
SCHEMBL153387 0.83 CYP19A1 (0.55) ELANECYP19A1MAPTKMT2AALDH1A1
Butane SCHEMBL2853445 0.83 KMT2A (0.53) ELANECYP19A1MAPTKMT2AALDH1A1
Butane SCHEMBL4836967 0.82 KMT2A (0.52) MAPTKMT2AALDH1A1LMNAHSD17B10
Thiophene SCHEMBL27670533 0.81 CYP19A1 (0.44) ELANECYP19A1MAPTKMT2AALDH1A1
SCHEMBL6835003 0.81 ELANE (0.47) ELANECYP19A1MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115925543-A Synthesis method of diethyl phenylethylmalonate 南通森萱药业有限公司 2023-04-07 CN claimed
EP-0674233-B1 Recording sheets XEROX CORP (US) 2000-05-24 EP claimed
US-5928765-A Recording sheets XEROX CORPORATION (US) 1999-07-27 US claimed
EP-0674233-A2 Recording sheets XEROX CORPORATION (US) 1995-09-27 EP claimed
US-4952649-A COORDINATION CATALYSTS USING BOTH AN ELECTRON DONOR AND ESTERS OF POLYCARBOXYLIC ACIDS; STEREOSPECIFIC; DURABILITY MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-08-28 US claimed
US-4292142-A MIXTURE OF PHTHALIC ANHYDRIDE AND MALEIC ANHYDRIDE INTERNATIONAL SYNTHETIC RUBBER CO., LTD. (GB) 1981-09-29 US claimed
US-20240191594-A1 Cement Top Jobs In Wellbore Annuli Using Expandable Compositions CHEVRON U.S.A. INC. 2024-06-13 US disclosed
CN-114805647-B Catalyst composition for olefin polymerization and application thereof 北京肯佰恩科技发展有限公司 2024-03-29 CN disclosed
US-20240026206-A1 METHODS OF USING EXPANDABLE POLYMER GROUT FOR PLUG AND ABANDONMENT APPLICATIONS CHEVRON AUSTRALIA PTY LTD (AU) 2024-01-25 US disclosed
US-20240026749-A1 DEPLOYMENT METHODS FOR EXPANDABLE POLYMER GROUT FOR PLUG AND ABANDONMENT APPLICATIONS CHEVRON AUSTRALIA PTY LTD (AU) 2024-01-25 US disclosed
US-11390060-B2 Surface treatment to enhance bonding of composite materials CYTEC INDUSTRIES INC. (US) 2022-07-19 US disclosed
WO-2022132551-A1 METHODS OF USING EXPANDABLE POLYMER GROUT FOR PLUG AND ABANDONMENT APPLICATIONS CHEVRON AUSTRALIA PTY LTD (AU) 2022-06-23 WO disclosed
WO-2022132552-A1 DEPLOYMENT METHODS FOR EXPANDABLE POLYMER GROUT FOR PLUG AND ABANDONMENT APPLICATIONS CHEVRON U.S.A. INC. (US) 2022-06-23 WO disclosed
US-4982016-A REDUCTION CARTER-WALLACE, INC. (US) 1991-01-01 US disclosed
US-4868327-A Synthesis of 2-phenyl-1,3-propanediol CARTER-WALLACE, INC. (US) 1989-09-19 US disclosed
EP-0173041-B1 2-SUBSTITUTED-1,3-PROPYLIDENEDIPHOSPHONATE DERIVATIVES, THE PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYMPHAR S.A. (CH) 1988-11-30 EP disclosed
US-4696920-A CARDIOVASCULAR DISORDERS SYMPHAR S.A. (CH) 1987-09-29 US disclosed
EP-0173041-A1 2-Substituted-1,3-propylidenediphosphonate derivatives, the process for their preparation and pharmaceutical compositions containing them SYMPHAR S.A. (CH) 1986-03-05 EP disclosed
US-4230850-A HYPOTENSIVE AGENTS, VASODILATION LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1980-10-28 US disclosed
US-4036985-A Mono substituted malonic acid diamides and process of preparing them AMATO JOSE 1977-07-19 US disclosed