Butane

Butane

SCHEMBL3016092

CCCC.O=C(O)c1coc(C(=O)O)c1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DAO P14920 1/20 0.40
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
PTGER4 P35408 1/20 0.37
RARB P10826 6/20 0.37
PLA2G2A P14555 1/20 0.36
TPMT P51580 1/20 0.35
KMT2A Q03164 2/20 0.35
BCL2 P10415 1/20 0.35
MEN1 O00255 1/20 0.35
RARA P10276 1/20 0.35
MAPT P10636 1/20 0.35
MTOR P42345 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34

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
SCHEMBL69933 0.89 NR4A2 (0.43) NR4A2ALDH1A1L3MBTL1DAOPTGER4
SCHEMBL26907933 0.89 NR4A2 (0.43) NR4A2ALDH1A1L3MBTL1DAOPTGER4
Hydrochloric Acid SCHEMBL28355104 0.87 NR4A2 (0.42) NR4A2ALDH1A1L3MBTL1DAOPTGER4
Ethylene SCHEMBL22371863 0.85 NR4A2 (0.41) NR4A2ALDH1A1L3MBTL1DAOPTGER4
SCHEMBL1185478 0.84 NR4A2 (0.41) NR4A2ALDH1A1L3MBTL1DAORXRA
1,3-Propanediol SCHEMBL25435443 0.82 NR4A2 (0.37) NR4A2ALDH1A1L3MBTL1DAOPTGER4
SCHEMBL6234778 0.79 NR4A2 (0.43) NR4A2ALDH1A1L3MBTL1DAOTPMT
SCHEMBL28250607 0.79 LMNA (0.49) NR4A2ALDH1A1DAOPLA2G2AKMT2A
SCHEMBL13268978 0.78 CYP2C9 (0.50) ALDH1A1KMT2AMEN1MAPT
SCHEMBL20624751 0.78 CYP2C9 (0.50) NR4A2ALDH1A1L3MBTL1DAOMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12163008-B2 Production and use of plasticizers based on 2,4-isomer of furandicarboxylic acid diesters BRASKEM S.A. (BR) 2024-12-10 US disclosed
CN-114773807-B Polyester composition, and preparation method and application thereof 吉林建筑大学 2023-10-03 CN disclosed
EP-4157826-A1 PRODUCTION AND USE OF PLASTICIZERS BASED ON 2,4-ISOMER OF FURANDICARBOXYLIC ACID DIESTERS Braskem S.A. (BR) 2023-04-05 EP disclosed
WO-2021240471-A1 PRODUCTION AND USE OF PLASTICIZERS BASED ON 2,4-ISOMER OF FURANDICARBOXYLIC ACID DIESTERS BRASKEM S.A. (BR) 2021-12-02 WO disclosed
US-20210371622-A1 PRODUCTION AND USE OF PLASTICIZERS BASED ON 2,4-ISOMER OF FURANDICARBOXYLIC ACID DIESTERS BRASKEM S.A. (BR) 2021-12-02 US disclosed
US-9102793-B2 Polyester resin, method of producing the same, composition for molded article and molded article CANON KABUSHIKI KAISHA (JP) 2015-08-11 US disclosed
US-20130225784-A1 POLYESTER RESIN, METHOD OF PRODUCING THE SAME, COMPOSITION FOR MOLDED ARTICLE AND MOLDED ARTICLE CANON KABUSHIKI KAISHA (JP) 2013-08-29 US disclosed
CN-101945919-B Polyester resin, method of producing the same, composition for molded article and molded article CANON KK 2013-06-12 CN disclosed
US-8420769-B2 Polyester resin, method of producing the same, composition for molded article and molded article CANON KABUSHIKI KAISHA (JP) 2013-04-16 US disclosed
EP-2252645-A1 POLYESTER RESIN, METHOD OF PRODUCING THE SAME, COMPOSITION FOR MOLDED ARTICLE AND MOLDED ARTICLE Canon Kabushiki Kaisha (JP) 2010-11-24 EP disclosed
US-20100174044-A1 POLYESTER RESIN, METHOD OF PRODUCING THE SAME, COMPOSITION FOR MOLDED ARTICLE AND MOLDED ARTICLE CANON KABUSHIKI KAISHA (JP) 2010-07-08 US disclosed
WO-2009104780-A1 POLYESTER RESIN, METHOD OF PRODUCING THE SAME, COMPOSITION FOR MOLDED ARTICLE AND MOLDED ARTICLE CANON KABUSHIKI KAISHA (JP) 2009-08-27 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 (2 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-20210371622-A1 PRODUCTION AND USE OF PLASTICIZERS BASED ON 2,4-ISOMER OF FURANDICARBOXYLIC ACID DIESTERS DDT, HPD, PFKFB2 NR4A2 594/4885ALDH1A1 895/4885L3MBTL1 4292/4885
US-12163008-B2 Production and use of plasticizers based on 2,4-isomer of furandicarboxylic acid diesters DDT, HPD, PFKFB2 NR4A2 594/4885ALDH1A1 895/4885L3MBTL1 4292/4885

“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.