1,4-Butanediol

1,4-Butanediol

SCHEMBL4463482

CC(C)(S)C(=O)O.CC(C)(S)C(=O)O.OCCCCO

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
CAMK2A Q9UQM7 1/20 0.39
TSHR P16473 3/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP4F2 P78329 3/20 0.38
CYP4A11 Q02928 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
ARG2 P78540 1/20 0.36
PPARA Q07869 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL4462242 0.97 FFAR1 (0.46) GPR84FFAR1FFAR4CAMK2ATSHR
1,4-Butanediol SCHEMBL3009897 0.89 GPR84 (0.42) GPR84FFAR1FFAR4CAMK2ATSHR
Ethylene Glycol SCHEMBL1271417 0.88 TSHR (0.42) CAMK2ATSHRALDH1A1PPARACYP2D6
Ethylene Glycol SCHEMBL1171759 0.88 TSHR (0.42) CAMK2ATSHRALDH1A1PPARACYP2D6
1,6-Hexanediol SCHEMBL28500023 0.86 FFAR1 (0.46) GPR84FFAR1FFAR4CAMK2ATSHR
Ethylene Glycol SCHEMBL1271413 0.83 TSHR (0.38) TSHRALDH1A1PPARACYP2D6CYP2C19
Alcohol SCHEMBL29120271 0.82 ALDH1A1 (0.42) TSHRALDH1A1TDP1PPARACYP2D6
Pivalate SCHEMBL6905029 0.82 GPR84 (0.46) GPR84FFAR1FFAR4CAMK2ATSHR
SCHEMBL9051285 0.82 CYP4F2 (0.38) GPR84FFAR1FFAR4CAMK2ATSHR
SCHEMBL306968 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240110071-A1 Ultraviolet-Curable Water-Based Ink, Dispersion, Ultraviolet-Curable Water-Based Composition, and Printed Matter MITSUBISHI CHEMICAL CORPORATION (JP) 2024-04-04 US disclosed
EP-4328246-A1 ULTRAVIOLET-CURABLE AQUEOUS INK, DISPERSION, ULTRAVIOLET-CURABLE AQUEOUS COMPOSITION, AND PRINTED MATTER Mitsubishi Chemical Corporation (JP) 2024-02-28 EP disclosed
WO-2022225039-A1 ULTRAVIOLET-CURABLE AQUEOUS INK, DISPERSION, ULTRAVIOLET-CURABLE AQUEOUS COMPOSITION, AND PRINTED MATTER 三菱ケミカル株式会社 2022-10-27 WO disclosed
US-7569327-B2 Curable polymer compound SHOWDA DENKO K.K. (JP) 2009-08-04 US disclosed
EP-1629046-B1 CURABLE POLYMER COMPOUND SHOWA DENKO KK (JP) 2008-05-14 EP disclosed
US-20070021571-A1 Curable polymer compound SHOWA DENKO K.K. (JP) 2007-01-25 US disclosed
US-20060079593-A1 Hexaarylbiimidazole compounds and photopolymerization initiator compositions containing the same SHOWA DENKO K.K. (JP) 2006-04-13 US disclosed
US-20060041053-A1 Color filter black matrix resist composition and carbon black dispersion composition used for the composition SHOWA DENKO K.K. (JP) 2006-02-23 US disclosed
US-20060036023-A1 Color filter black matrix resist composition SHOWA DENKO K.K. (JP) 2006-02-16 US disclosed