Butane

Butane

SCHEMBL2590833

CCCC.O=C(O)CNCC(=O)O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.53
HDAC3 O15379 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
AKR1B1 P15121 1/20 0.46
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 7/20 0.43
PPARD Q03181 7/20 0.43
PPARA Q07869 7/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43
PTPN1 P18031 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43

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
SCHEMBL27023 0.87
SCHEMBL4816014 0.87 LMNA (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
Acetic Acid SCHEMBL30401693 0.84 CTH (0.48) FFAR3HDAC3HDAC1HDAC2HDAC8
Acetic Acid SCHEMBL31437203 0.84 CTH (0.48) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL667660 0.83 LMNA (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8
Ammonia Solution, Strong SCHEMBL7262621 0.83 LMNA (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL9393647 0.83 LMNA (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8
Water SCHEMBL9703549 0.83 LMNA (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL4015593 0.83 LMNA (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8
Ammonia Solution, Strong SCHEMBL7262619 0.83 LMNA (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112080560-B Use of CD177 for the preparation of a product for diagnosing biliary tract occlusion 广州市妇女儿童医疗中心(广州市妇幼保健院、广州市儿童医院、广州市妇婴医院、广州市妇幼保健计划生育服务中心) 2024-01-26 CN disclosed
CN-117288962-A Application of reagent for detecting marker combination in preparation of biliary tract locking diagnosis product 广州市妇女儿童医疗中心 2023-12-26 CN disclosed
EP-2729664-B1 SAMPLING PROCEDURE FOR POLYMER-BASED SOLUTIONS USED IN UNDERGROUND FORMATIONS SNF GROUP (FR) 2023-08-02 EP disclosed
WO-2022045240-A1 SEALING AGENT FOR LIQUID CRYSTAL DISPLAY ELEMENT, VERTICAL CONDUCTION MATERIAL, AND LIQUID CRYSTAL DISPLAY ELEMENT 積水化学工業株式会社 2022-03-03 WO disclosed
US-10364262-B2 Method for the synthesis of N-phosphonomethyliminodiacetic acid MONSANTO TECHNOLOGY LLC (US) 2019-07-30 US disclosed
CN-104854117-B Process for the synthesis of N-phosphonomethyliminodiacetic acid 孟山都技术有限责任公司 2018-12-25 CN disclosed
CN-103649462-B The sampling method of polymer-based solution for subterranean strata S.P.C.M.股份公司 2018-08-07 CN disclosed
US-9714889-B2 Sampling procedure for polymer-based solutions used in underground formations S.P.C.M. SA (FR) 2017-07-25 US disclosed
EP-2563122-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2016-06-08 EP disclosed
CN-102428157-B The water-soluble polymers of single mixed thing and the new formulation of stabilization additives that chemistry improves oil recovery injection fluid is can be used for for injecting S.P.C.M. S.A. (FR) 2015-09-09 CN disclosed
US-9040518-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2015-05-26 US disclosed
US-20140134749-A1 SAMPLING PROCEDURE FOR POLYMER-BASED SOLUTIONS USED IN UNDERGROUND FORMATIONS S.P.C.M. SA (FR) 2014-05-15 US disclosed
EP-2729664-A1 SAMPLING PROCEDURE FOR POLYMER-BASED SOLUTIONS USED IN UNDERGROUND FORMATIONS S.P.C.M. SA (FR) 2014-05-14 EP disclosed
CN-103649462-A Sampling procedure for polymer-based solutions used in underground formations SPCM SA 2014-03-19 CN disclosed
WO-2014012986-A1 METHOD FOR THE SYNTHESIS OF N-PHOSPHONOMETHYLIMINODIACETIC ACID STRAITMARK HOLDING AG (CH) 2014-01-23 WO disclosed
EP-2563122-A1 CHEMICAL COMPOUNDS Glaxosmithkline LLC (US) 2013-03-06 EP disclosed
US-20130029938-A1 Chemical Compounds GLAXOSMITHKLINE LLC (US) 2013-01-31 US disclosed
WO-2013004650-A1 SAMPLING PROCEDURE FOR POLYMER-BASED SOLUTIONS USED IN UNDERGROUND FORMATIONS S.P.C.M. SA (FR) 2013-01-10 WO disclosed
CN-102428157-A Novel formulation of water-soluble polymers and stabilizing additives for injection of a single compound useful as injection fluid for chemical enhanced oil recovery SPCM SA 2012-04-25 CN disclosed
WO-2011137135-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-11-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130029938-A1 Chemical Compounds CYP11B1, GOT2, CYP11B2 FFAR3 644/4885HDAC3 806/4885HDAC1 785/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.