Butane

Butane

SCHEMBL21562

CCCC.Cl.[AlH3]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Butane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ 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 SCHEMBL10400622 1.00 TSHR (0.40)
Butane SCHEMBL3109038 1.00
Butane SCHEMBL9720567 0.94 TSHR (0.36)
Butane SCHEMBL11329075 0.94 TSHR (0.36)
Butane SCHEMBL18039280 0.93
Butane SCHEMBL5851369 0.93
Butane SCHEMBL814744 0.93
Butane SCHEMBL465278 0.93
Butane SCHEMBL250788 0.93
Butane SCHEMBL28863388 0.93 TSHR (0.44)

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

Appears in 18820 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119708301-B Co-CFA-1-based butadiene polymerization catalyst and preparation and application thereof JIANG University OF TECHNOLOGY (CN) 2026-05-26 CN claimed
CN-121108200-B Nickel complex, preparation method, catalyst composition and application thereof, and method for copolymerization and homopolymerization of ethylene and alpha-olefin 中石油(上海)新材料研究院有限公司 2026-05-19 CN claimed
CN-118930736-B Semi-hydrogenated bio-based terpene and conjugated diene multicomponent random copolymerization elastomer and preparation method and application thereof 中国科学院青岛生物能源与过程研究所 2026-05-19 CN claimed
CN-119060253-B Hydrogenated bio-based terpene binary random copolymer elastomer and preparation method and application thereof 中国科学院青岛生物能源与过程研究所 2026-05-19 CN claimed
CN-122036812-A Preparation method of biphenyl binuclear alpha-diimine nickel-based catalyst and application of catalyst in ethylene chain walking polymerization 安徽大学 2026-05-15 CN claimed
CN-122010958-A Synthesis method of natural product Pyrroloazocine indole alkaloid skeleton 中国医学科学院药物研究所 2026-05-12 CN claimed
US-12600816-B2 Alkylene oxide polymerization using aluminum compounds and phosphorus-nitrogen bases DOW GLOBAL TECHNOLOGIES LLC (US) 2026-04-14 US claimed
US-20260092129-A1 Controlled Molecular Weight Distribution of Isobutylene-Based Elastomer Compositions and Methods Related Thereto EXXONMOBIL CHEMICAL PATENTS INC (US) 2026-04-02 US claimed
EP-4711376-A1 METALLOCENE COMPOUND, CATALYST COMPOSITION ,AND METHOD FOR PREPARING ETHYLENE-CYCLIC OLEFIN COPOLYMER China Petroleum & Chemical Corporation (CN) 2026-03-18 EP claimed
EP-4711388-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, PREPARATION METHOD THEREFOR AND USE THEREOF China Petroleum & Chemical Corporation (CN) 2026-03-18 EP claimed
US-4018867-A Process for the disposal of aluminum containing waste materials ETHYL CORPORATION (US) 1977-04-19 US claimed
US-4016342-A COPOLYMERIZATION OF ETHYLENE, COORDINATION CATALYSTS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1977-04-05 US claimed
US-4000211-A NICKEL CHLORIDE COMPLEXES PHILLIPS PETROLEUM COMPANY (US) 1976-12-28 US claimed
US-3984387-A ZIEGLER CATALYSTS THE DOW CHEMICAL COMPANY (US) 1976-10-05 US claimed
US-3966637-A REACTION PRODUCT OF TUNGSTEN HEXACHLORIDE, 2-CHLOROETHANOL AND 2,2,2-TRICHLOROETHANOL, AN ORGANOMETALLIC ALUMINUM BAYER AKTIENGESELLSCHAFT (DT) 1976-06-29 US claimed
US-3960765-A REDUCING TITANIUM TETRACHLORIDE WITH AN ORGANOALUMINUM COMPOUND, COMPLEXING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-06-01 US claimed
US-3959234-A CATALYSTS OF ORGANOALUMINUM COMPOUNDS AND A TUNGSTEN OR MOLYBDENUM COMPOUND, RING-OPENING SHOWA DENKO KABUSHIKI KAISHA (JA) 1976-05-25 US claimed
US-3935180-A MULTISTAGE 1,2 AND 1,4 CATALYTIC POLYMERIZATION UBE INDUSTRIES, LTD. (JA) 1976-01-27 US claimed
US-3933942-A ORGANO-ALUMINUM CATALYST EXXON RESEARCH AND ENGINEERING COMPANY (US) 1976-01-20 US claimed
US-3931135-A TITANIUM TRICHLORIDE-ORGANO-ALUMINUM CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-06 US claimed