Butane

Butane

SCHEMBL1033068

C=C(C)C(=O)OC(N)CCC.CCCC

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 4/20 0.39
THRB P10828 1/20 0.36
GRIK1 P39086 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
GRIK2 Q13002 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 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
SCHEMBL1033366 0.98 ALDH1A1 (0.43) ALDH1A1TSHRTHRBGRIK1SLC1A3
Butane SCHEMBL5052484 0.87 TSHR (0.47) TSHRGRIK1SLC1A3SLC1A2SLC1A1
SCHEMBL9586524 0.87 TSHR (0.46) ALDH1A1TSHRTHRBGRIK1SLC1A3
Butane SCHEMBL1031461 0.86 TSHR (0.40) ALDH1A1TSHRTHRBTDP1
SCHEMBL1562732 0.85 TSHR (0.49) TSHRGRIK1SLC1A3SLC1A2SLC1A1
SCHEMBL1562175 0.84 TSHR (0.51) TSHRGRIK1SLC1A2SLC1A1GRIK2
SCHEMBL9586888 0.84 TSHR (0.51) TSHRGRIK1SLC1A2SLC1A1GRIK2
SCHEMBL9586357 0.84 TSHR (0.51) TSHRGRIK1SLC1A2SLC1A1GRIK2
SCHEMBL1562265 0.84 TSHR (0.51) TSHRGRIK1SLC1A2SLC1A1GRIK2
SCHEMBL9480412 0.83 SLC1A2 (0.39) ALDH1A1TSHRGRIK1SLC1A3SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4213980-A1 AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES Encapsys, LLC (US) 2023-07-26 EP disclosed
WO-2022061103-A1 AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES ENCAPSYS, LLC (US) 2022-03-24 WO disclosed
EP-1765276-B1 SHATTER RESISTANT ENCAPSULATED COLORANTS FOR NATURAL SKIN APPEARANCE BASF SE (DE) 2013-11-06 EP disclosed
EP-2276797-B1 POLYMER ENCAPSULATED COLOURANTS BY SPRAY DRYING BASF SE (DE) 2012-11-21 EP disclosed
US-20120149265-A1 PARTICULATE COMPOSITION BASF SE (DE) 2012-06-14 US disclosed
EP-2449050-A1 PARTICULATE COMPOSITION BASF SE (DE) 2012-05-09 EP disclosed
US-20110147965-A1 POLYMER ENCAPSULATED COLOURANTS BY SPRAY DRYING BASF SE (DE) 2011-06-23 US disclosed
US-7947294-B2 Shatter resistant encapsulated colorants for natural skin appearance BASF SE (DE) 2011-05-24 US disclosed
EP-2276797-A1 POLYMER ENCAPSULATED COLOURANTS BY SPRAY DRYING BASF SE (DE) 2011-01-26 EP disclosed
WO-2011000688-A1 PARTICULATE COMPOSITION BASF SE (DE) 2011-01-06 WO disclosed
EP-2029090-A1 BLEED-RESISTANT COLORED MICROPARTICLES Ciba Holding Inc. (CH) 2009-03-04 EP disclosed
EP-2029091-A2 BLEED-RESISTANT COLORED MICROPARTICLES AND SKIN CARE COMPOSITIONS COMPRISING THEM The Procter and Gamble Company (US) 2009-03-04 EP disclosed
US-20080281014-A1 Nanosubstance-Containing Composition, Process for Producing the Same, and Composite Made With the Same MITSUBISHI RAYON CO., LTD. (JP) 2008-11-13 US disclosed
US-20070287789-A1 Bleed-resistant colored microparticles CIBA SPECIALTY CHEMICALS CORP. 2007-12-13 US disclosed
WO-2007141742-A2 BLEED-RESISTANT COLORED MICROPARTICLES AND SKIN CARE COMPOSITIONS COMPRISING THEM THE PROCTER & GAMBLE COMPANY (US) 2007-12-13 WO disclosed
WO-2007141169-A1 BLEED-RESISTANT COLORED MICROPARTICLES CIBA HOLDING INC. (CH) 2007-12-13 WO disclosed
US-20070286824-A1 Bleed-resistant colored microparticles and skin care compositions comprising them PROCTER & GAMBLE COMPANY, THE 2007-12-13 US disclosed
EP-1765276-A1 SHATTER RESISTANT ENCAPSULATED COLORANTS FOR NATURAL SKIN APPEARANCE CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-28 EP disclosed
WO-2005123009-A1 SHATTER RESISTANT ENCAPSULATED COLORANTS FOR NATURAL SKIN APPEARANCE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-12-29 WO disclosed
US-20050276774-A1 Shatter resistant encapsulated colorants for natural skin appearance CIBA CORPORATION 2005-12-15 US disclosed