Butane

Butane

SCHEMBL5577989

CCCC.N#CS

nearest known ligand 0.00

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⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Butane SCHEMBL6577949 1.00 CA1 (0.55)
Butane SCHEMBL16053106 0.96
Propane SCHEMBL6578035 0.86
Propane SCHEMBL19371522 0.86
Propane SCHEMBL11425893 0.86 CA1 (0.60)
Hexane SCHEMBL4939829 0.84
Pentane SCHEMBL19371507 0.84 TSHR (0.54)
Hexane SCHEMBL19371513 0.84 TSHR (0.50)
Propylamine SCHEMBL9666785 0.81
Thiocyanic Acid SCHEMBL6580536 0.81 TSHR (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1723241-B1 TRANSGENIC EXPRESSION CONSTRUCTS FOR VEGETATIVE PLANT TISSUE SPECIFIC EXPRESSION OF NUCLEIC ACIDS BASF PLANT SCIENCE GMBH (DE) 2012-07-11 EP disclosed
US-20070174927-A1 Transgenic expression constructs for vegetative plant tissue specific expression of nucleic acids BASF PLANT SCIENCE GMBH (DE) 2007-07-26 US disclosed
EP-1723241-A1 TRANSGENIC EXPRESSION CONSTRUCTS FOR VEGETATIVE PLANT TISSUE SPECIFIC EXPRESSION OF NUCLEIC ACIDS BASF Plant Science GmbH (DE) 2006-11-22 EP disclosed
WO-2005085450-A1 TRANSGENIC EXPRESSION CONSTRUCTS FOR VEGETATIVE PLANT TISSUE SPECIFIC EXPRESSION OF NUCLEIC ACIDS BASF PLANT SCIENCE GMBH (DE) 2005-09-15 WO disclosed
EP-1120435-B1 APPARATUS AND METHOD FOR PRODUCING RESIN TEIJIN LTD (JP) 2004-05-06 EP disclosed
US-6562936-B1 Resin excellent in hydrolysis and heat stability such as a reduction in molecular weight at the time of molding and color retention and moldability such as releasability and transferability, rarely experiences residence deterioration TEIJIN LIMITED (JP) 2003-05-13 US disclosed
US-6509435-B1 Heat resistance, stability; moldings TEIJIN LIMITED (JP) 2003-01-21 US disclosed
EP-1191049-A1 POLYCARBONATE, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2002-03-27 EP disclosed
EP-1120435-A1 APPARATUS AND METHOD FOR PRODUCING RESIN TEIJIN LIMITED (JP) 2001-08-01 EP disclosed