1,4-Butanediol

1,4-Butanediol

SCHEMBL575106

O=C(O)O.OCCCCO

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of 1,4-Butanediol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.59
FFAR1 O14842 1/20 0.59
FFAR4 Q5NUL3 1/20 0.59
CAMK2A Q9UQM7 1/20 0.56
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
LMNA P02545 4/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.38
ARG2 P78540 1/20 0.36
OR51E2 Q9H255 1/20 0.35

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
Bicarbonate SCHEMBL28326314 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
Bicarbonate SCHEMBL28191659 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,5-Pentanediol SCHEMBL29150346 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
Bicarbonate SCHEMBL28380298 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,6-Hexanediol SCHEMBL6707356 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,5-Pentanediol SCHEMBL575113 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,6-Hexanediol SCHEMBL28984424 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,6-Hexanediol SCHEMBL28737103 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,6-Hexanediol SCHEMBL628080 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1
1,6-Hexanediol SCHEMBL29109662 0.96 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591131-A Preparation method of fluorophosphate 浙江省化工研究院有限公司 2025-03-11 CN claimed
CN-113646169-B 2 Component solvent-based adhesive composition 陶氏环球技术有限责任公司 2024-05-24 CN claimed
CN-118022388-A Apparatus and method for devolatilizing polymers 浙江大学 2024-05-14 CN claimed
CN-113518790-B Two-component solvent-based adhesive composition 陶氏环球技术有限责任公司 2023-08-25 CN claimed
CN-113956505-B Polylactic acid emulsion, and preparation method and application thereof 海南赛诺实业有限公司 2023-05-16 CN claimed
CN-116041696-A Multiblock copolymer based on long-chain polyamide and aliphatic polycarbonate and preparation method thereof 中国五环工程有限公司 2023-05-02 CN claimed
CN-112961885-B Method for synthesizing enzyme-catalyzed poly (1, 4-butanediol carbonate) 源创核新(北京)新材料科技有限公司 2022-08-19 CN claimed
CN-112194783-B Method for preparing high molecular weight poly (butylene glycol) carbonate by organic base and Ti/Si composite material catalysis 中国科学院青岛生物能源与过程研究所 2022-04-22 CN claimed
CN-112280028-B Method for preparing high molecular weight poly (butylene glycol) carbonate by catalyzing inorganic salt and Ti/Si composite material 中国科学院青岛生物能源与过程研究所 2022-04-22 CN claimed
CN-113956428-A Novel polyurethane material and preparation method thereof 中国科学院山西煤炭化学研究所 2022-01-21 CN claimed
CN-113646169-A 2-component solvent-based adhesive composition 陶氏环球技术有限责任公司 2021-11-12 CN claimed
CN-113518790-A Two-component solvent-based adhesive composition 陶氏环球技术有限责任公司 2021-10-19 CN claimed
CN-112961885-A Method for synthesizing enzyme catalyzed poly 1, 4-butanediol carbonate 源创核新(北京)新材料科技有限公司 2021-06-15 CN claimed
CN-112280028-A Method for preparing high molecular weight poly (butylene glycol) carbonate by catalyzing inorganic salt and Ti/Si composite material 中国科学院青岛生物能源与过程研究所 2021-01-29 CN claimed
CN-112194783-A Method for preparing high molecular weight poly (butylene glycol) carbonate by organic base and Ti/Si composite material catalysis 中国科学院青岛生物能源与过程研究所 2021-01-08 CN claimed
CN-109229874-B Preparation method of plastic packaging material for refrigeration 湖州达立智能设备制造有限公司 2020-12-08 CN claimed
US-9556406-B2 Compositions comprising benefit agent and aprotic solvent MILLIKEN & COMPANY (US) 2017-01-31 US claimed
US-9540601-B2 Composition comprising benefit agent and aprotic solvent THE PROCTER & GAMBLE COMPANY (US) 2017-01-10 US claimed
US-4307032-A Process for the preparation of dialkyl carbonates BAYER AKTIENGESELLSCHAFT (DE) 1981-12-22 US claimed
US-4083876-A ALKYLENE CARBONATES WITH HYDROGEN SULFIDE ERDOLCHEMIE GMBH (DT) 1978-04-11 US claimed