Butane

Butane

SCHEMBL1003138

CCCC.CCCC.CCCC.F.F.F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.40
ALDH1A1 P00352 3/20 0.33
SLC22A1 O15245 1/20 0.33
TDP1 Q9NUW8 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
Butane SCHEMBL4435590 1.00
Butane SCHEMBL28786322 1.00
Butane SCHEMBL7724220 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL8454628 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL1019190 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL4387446 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL7457770 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL1019191 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL11764235 1.00 TSHR (0.44) TSHRLMNATHRBALDH1A1SLC22A1
Butane SCHEMBL9811030 0.93

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022025554-A1 MONOAMINE COMPOUND FOR SYNTHESIZING EMULSIFIER 한진케미칼 주식회사 2022-02-03 WO claimed
WO-2023224413-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING ELEMENT 엘티소재주식회사 2023-11-23 WO disclosed
WO-2022025555-A1 MULTI-CHAIN-TYPE EPOXY RESIN EMULSIFIER 한진케미칼 주식회사 2022-02-03 WO disclosed
WO-2022025554-A1 MONOAMINE COMPOUND FOR SYNTHESIZING EMULSIFIER 한진케미칼 주식회사 2022-02-03 WO disclosed
CN-109641052-A The combination treatment of BACE-1 inhibitor and anti-N3pGlu A β antibody 伊莱利利公司 2019-04-16 CN disclosed
CN-108290860-A Imino group tetrahydropyrimidine ketone derivatives as PLASMEPSIN V inhibitor UCB生物制药私人有限公司 2018-07-17 CN disclosed
CN-104302683-B Aoxidize the manufacture method of methylene base co-polymer 三菱瓦斯化学株式会社 2017-07-28 CN disclosed
CN-102924411-B The synthetic method of Triptolide alcohol intermediate 兰州大学 2016-08-17 CN disclosed
CN-102321022-B Method for preparing meptazinol and analogs thereof CHINA RESOURCES DOUBLE CRANE PHARMACEUTICAL CO LTD 2014-11-12 CN disclosed
CN-103237795-A Substituted oxadiazole compounds and their use as S1P1Use of agonists BRISTOL MYERS SQUIBB CO 2013-08-07 CN disclosed
WO-2011004980-A2 METHOD FOR PREPARING TRICYCLIC DERIVATIVES 제일약품주식회사 (KR) 2011-01-13 WO disclosed
JP-2008137906-A METHOD FOR PRODUCING SKIN CARE PREPARATION AND ITS PRODUCTION INTERMEDIATE NOGUCHI INST 2008-06-19 JP disclosed
EP-1122244-A1 Uracil compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-08 EP disclosed