1,3-Butanediol

1,3-Butanediol

SCHEMBL3883350

C=CC(=O)O.C=CC(=O)O.CC(O)CCO

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
ALOX15 P16050 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 5/20 0.34
ALDH1A1 P00352 5/20 0.34
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33
GABRA6 Q16445 2/20 0.33
GABRG1 Q8N1C3 2/20 0.33
GABRG3 Q99928 2/20 0.33

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
1,3-Butanediol SCHEMBL659565 1.00 LMNA (0.46) LMNAALOX15HSD17B10TSHRALDH1A1
1,3-Butanediol SCHEMBL20537096 0.94 LMNA (0.40) LMNAALOX15HSD17B10TSHRALDH1A1
1,3-Butanediol SCHEMBL3107976 0.92 THRB (0.39) LMNAALOX15HSD17B10TSHRALDH1A1
Methacrylic Acid SCHEMBL9167917 0.90 ALOX15 (0.38) LMNAALOX15HSD17B10ALDH1A1
1,3-Butanediol SCHEMBL3376246 0.86 ALDH1A1 (0.34) ALOX15TSHRALDH1A1GABRPGABRD
1,3-Butanediol SCHEMBL7212825 0.86 HSD17B10 (0.41) LMNAHSD17B10TSHRALDH1A1TDP1
Acrylic Acid SCHEMBL28214591 0.85 LMNA (0.40) LMNAALOX15HSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL30697274 0.84 LMNA (0.48) LMNAALOX15HSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL4556689 0.84 TDP1 (0.48) LMNAALOX15HSD17B10TSHRALDH1A1
3-Methylbutanol SCHEMBL27167097 0.84 LMNA (0.48) LMNAALOX15HSD17B10TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1913103-B1 STRONGLY ADHERENT COATINGS CIBA HOLDING INC (CH) 2009-01-14 EP claimed
EP-1456250-B1 POLY(VINYLALCOHOL),CO-POLY(VINYLAMINE) POLYMERS COMPRISING FUNCTIOAL MOIETIES CIBA HOLDING INC (CH) 2009-01-14 EP claimed
EP-1904210-A2 FILTER MEDIUM FOR TECHNICAL APPLICATIONS, AND METHOD FOR THE PRODUCTION THEREOF Mahle International GmbH (DE) 2008-04-02 EP claimed
EP-1476509-B1 SELF-POLISHING ANTIFOULING PAINT JOTUN AS (NO) 2007-04-11 EP claimed
WO-2007006292-A2 FILTER MEDIUM FOR TECHNICAL APPLICATIONS, AND METHOD FOR THE PRODUCTION THEREOF MAHLE INTERNATIONAL GMBH (DE) 2007-01-18 WO claimed
EP-0399755-B1 Light-sensitive composition and presensitized plate for use in making lithographic printing plates FUJI PHOTO FILM CO LTD (JP) 1994-03-30 EP claimed
EP-0009690-B1 USE OF POLYVINYLIDENE CHLORIDE IN THE PREPARATION OF POLYMERIC MATERIALS THE DOW CHEMICAL COMPANY (US) 1982-10-27 EP claimed
EP-1904210-A2 FILTER MEDIUM FOR TECHNICAL APPLICATIONS, AND METHOD FOR THE PRODUCTION THEREOF Mahle International GmbH (DE) 2008-04-02 EP disclosed
EP-1476509-B1 SELF-POLISHING ANTIFOULING PAINT JOTUN AS (NO) 2007-04-11 EP disclosed
WO-2007006292-A2 FILTER MEDIUM FOR TECHNICAL APPLICATIONS, AND METHOD FOR THE PRODUCTION THEREOF MAHLE INTERNATIONAL GMBH (DE) 2007-01-18 WO disclosed
EP-1476509-A2 SELF-POLISHING ANTIFOULING PAINT Jotun AS (NO) 2004-11-17 EP disclosed
WO-2003070832-A2 SELF-POLISHING ANTIFOULING PAINT JOTUN AS (NO) 2003-08-28 WO disclosed
EP-0052776-B1 TWO-COAT METALLIC LACQUERING AND PROCESS FOR PREPARING IT BASF Lacke + Farben AG (DE) 1984-12-12 EP disclosed
EP-0017151-B1 COLD CURING MATERIALS FOR DENTAL PURPOSES WITH POLYMERISATION-ACTIVE SULFONES BAYER AG (DE) 1984-02-15 EP disclosed
EP-0052776-A2 Two-coat metallic lacquering and process for preparing it BASF Lacke + Farben AG (DE) 1982-06-02 EP disclosed
EP-0017151-A2 Cold curing materials for dental purposes with polymerisation-active sulfones BAYER AG (DE) 1980-10-15 EP disclosed