1,3-Butanediol

1,3-Butanediol

SCHEMBL1415145

CC(O)CCO.OCCCCO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 4/20 0.39
ALDH1A1 P00352 5/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
TRPA1 O75762 1/20 0.32

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 SCHEMBL8093341 1.00 TDP1 (0.44) TDP1SMN1; SMN2TSHRALDH1A1LMNA
1,5-Pentanediol SCHEMBL6423642 0.97 TSHR (0.43) TDP1SMN1; SMN2TSHRALDH1A1LMNA
1,3-Butanediol SCHEMBL28244301 0.97 TSHR (0.43) TDP1SMN1; SMN2TSHRALDH1A1LMNA
1,6-Hexanediol SCHEMBL2190350 0.97 TSHR (0.43) TDP1SMN1; SMN2TSHRALDH1A1LMNA
1,3-Butanediol SCHEMBL3458713 0.94 TDP1 (0.44) TDP1SMN1; SMN2TSHRALDH1A1LMNA
1,3-Butanediol SCHEMBL222874 0.90
1,3-Butanediol SCHEMBL3427715 0.90 TDP1 (0.53) TDP1TSHRALDH1A1LMNATHRB
1,3-Butanediol SCHEMBL227565 0.90
1,3-Butanediol SCHEMBL8176 0.90
1,3-Butanediol SCHEMBL9614790 0.89 TSHR (0.43) TDP1SMN1; SMN2TSHRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190038529-A1 ODOR-REDUCING DEVELOPER FOR OXIDATION DYES II HENKEL AG & CO. KGAA (DE) 2019-02-07 US claimed
US-20070047095-A1 Electrowetting system with stable movement SAMSUNG ELECTRO-MECHANICS CO., LTD. (KR) 2007-03-01 US claimed
US-6900360-B2 Condensation of acetaldehyde; hydrogenation DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2005-05-31 US claimed
CN-1546208-A Improved method for removing sulfur by vanadium based wet-type oxidization 南化集团研究院 2004-11-17 CN claimed
EP-0126676-A1 Process for preparing catalysts for treating exhaust gases from internal-combustion engines Société Française des Produits pour Catalyse "PRO-CATALYSE" (FR) 1984-11-28 EP claimed
US-12018115-B2 Polyurethane gel material, polyurethane gel, pseudo-biomaterial, and producing method of polyurethane gel MITSUI CHEMICALS, INC. (JP) 2024-06-25 US disclosed
CN-111868619-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2024-05-24 CN disclosed
CN-111777519-B Diamines 日产化学工业株式会社 2023-12-05 CN disclosed
CN-117148630-A Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2023-12-01 CN disclosed
CN-111868620-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2023-11-03 CN disclosed
CN-111971617-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element using same 日产化学株式会社 2023-06-20 CN disclosed
US-11596150-B2 Long chain glycolipids useful to avoid perishing or microbial contamination of materials IMD NATURAL SOLUTIONS GMB (DE) 2023-03-07 US disclosed
EP-0296205-A1 METHOD AND COMPOSITION FOR HAIR GROWTH IN COMMON PATTERN BALDNESS TRUSTEES OF BOSTON UNIVERSITY (US) 1988-12-28 EP disclosed
US-4792574-A Stable, low viscosity polymer/polyisocyanate dispersion made using a macromolecular monomer and a functional monomer OLIN CORPORATION (US) 1988-12-20 US disclosed
WO-1988004931-A1 METHOD AND COMPOSITION FOR HAIR GROWTH IN COMMON PATTERN BALDNESS TRUSTEES OF BOSTON UNIVERSITY (US) 1988-07-14 WO disclosed
EP-0126676-A1 Process for preparing catalysts for treating exhaust gases from internal-combustion engines Société Française des Produits pour Catalyse "PRO-CATALYSE" (FR) 1984-11-28 EP disclosed
US-4225478-A PRIMER PAINTS CELANESE CORPORATION (US) 1980-09-30 US disclosed
US-4182831-A Cationic epoxide resinous composition CELANESE POLYMER SPECIALTIES COMPANY (US) 1980-01-08 US disclosed
US-4063919-A POLYVINYL ALCOHOL MONSANTO COMPANY (US) 1977-12-20 US disclosed
US-3945837-A RESINOUS BINDER, HYDROCARBON SOLVENT, MODIFIED DYE SAKURA COLOR PRODUCTS CORPORATION (JA) 1976-03-23 US 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-11596150-B2 Long chain glycolipids useful to avoid perishing or microbial contamination of materials LPO, PLIN1, PLIN3 TDP1 4300/4885SMN1; SMN2 3722/4885TSHR 3661/4885
US-20190038529-A1 ODOR-REDUCING DEVELOPER FOR OXIDATION DYES II HAO2, SORD, AOX1 TDP1 4064/4885SMN1; SMN2 2172/4885TSHR 4652/4885

“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.