1,3-Butanediol

1,3-Butanediol

SCHEMBL162145

CC(O)CCO.CCCNCCC

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TSHR P16473 4/20 0.35
TDP1 Q9NUW8 1/20 0.35
PAOX Q6QHF9 1/20 0.34
ANPEP P15144 1/20 0.32
THRB P10828 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
1,6-Hexanediol SCHEMBL28079132 0.92 ALDH1A1 (0.41) ALDH1A1TSHRPAOXHSD17B10
SCHEMBL1231151 0.85
Hydrochloric Acid SCHEMBL5436004 0.83 ALDH1A1 (0.37) ALDH1A1TSHRTDP1PAOXANPEP
Hydroxyamine SCHEMBL1454942 0.83 ANPEP (0.38) ALDH1A1TSHRTDP1PAOXANPEP
Propylene Glycol SCHEMBL162912 0.82 TDP1 (0.56) ALDH1A1TSHRTDP1PAOXANPEP
1,3-Butanediol SCHEMBL28395358 0.82 TSHR (0.44) ALDH1A1TSHRTDP1THRBHSD17B10
SCHEMBL19921564 0.79 PAOX (0.47) ALDH1A1TSHRPAOX
Isopropyl Alcohol SCHEMBL4622975 0.79 PAOX (0.42) ALDH1A1TSHRTDP1PAOXANPEP
1,3-Butanediol SCHEMBL20543850 0.79
1,3-Butanediol SCHEMBL11799742 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112888424-B Film-forming cosmetic composition comprising polyurethane and crosslinked starch 欧莱雅 2023-11-21 CN claimed
US-11779534-B2 Film-forming cosmetic composition comprising polyurethane and cross-linked starch L'OREAL (FR) 2023-10-10 US claimed
CN-112888424-A Film-forming cosmetic composition comprising polyurethane and cross-linked starch 欧莱雅 2021-06-01 CN claimed
US-20210154128-A1 FILM-FORMING COSMETIC COMPOSITION COMPRISING POLYURETHANE AND CROSS-LINKED STARCH L'OREAL (FR) 2021-05-27 US claimed
WO-2024133697-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A COLD PLASMA TREATMENT AND OF A COMPOSITION COMPRISING A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133693-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A PARTICULAR COMPOSITION T AND THE APPLICATION OF A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133718-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A COMPOSITION T COMPRISING AN AMINO ACID AND THE APPLICATION OF A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133715-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A TREATMENT WITH A REDUCING AGENT AND OF A COMPOSITION COMPRISING A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A TREATMENT WITH A REDUCING AGENT AND OF A COMPOSITION COMPRISING A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133719-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS WHICH INVOLVES SPRAYING THE KERATIN HAIR FIBERS WITH A COMPOSITION COMPRISING A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT USING AN AIRBRUSH L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133698-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT, THE APPLICATION OF STEAM AND SHAPING AT A PARTICULAR TEMPERATURE. L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133716-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A TREATMENT WITH AN ALKALINE AGENT AND OF A COMPOSITION COMPRISING A (POLY)CARBODIIMIDE COMPOUND AND A COLOURING AGENT L'OREAL (FR) 2024-06-27 WO disclosed
WO-2024133696-A1 PROCESS FOR DYEING KERATIN HAIR FIBERS COMPRISING THE APPLICATION OF A (POLY)CARBODIIMIDE COMPOUND, A COMPOUND CONTAINING AT LEAST ONE CARBOXYLIC ACID GROUP, AN AMINO SILICONE AND A COLOURING AGENT. L'OREAL (FR) 2024-06-27 WO disclosed
EP-2028205-A1 Polyurethane dispersions based on polycarbonate polyols and suitable for use in personal care products Bayer MaterialScience LLC (US) 2009-02-25 EP disclosed
US-20090041689-A1 POLYURETHANE DISPERSIONS BASED ON POLYCARBONATE POLYOLS AND SUITABLE FOR USE IN PERSONAL CARE PRODUCTS BAYER MATERIALSCIENCE LLC (US) 2009-02-12 US disclosed
US-20090022678-A1 POLYURETHANE DISPERSIONS FOR USE IN PERSONAL CARE PRODUCTS COVESTRO LLC 2009-01-22 US disclosed
US-7452525-B1 Polyurethane dispersions based on polycarbonate polyols and suitable for use in personal care products BAYER MATERIALSCIENCE LLC 2008-11-18 US disclosed
US-7445770-B2 Polyurethane dispersions for use in personal care products BAYER MATERIALSCIENCE LLC (US) 2008-11-04 US disclosed
US-20080226569-A1 Polyurethane dispersions for use in personal care products BAYER MATERIALSCIENCE LLC 2008-09-18 US disclosed
EP-1970391-A2 Polyurethane dispersions for use in personal care products Bayer MaterialScience LLC (US) 2008-09-17 EP disclosed
CN-101264048-A Polyurethane dispersions for use in personal care products BAYER MATERIALSCIENCE LLC (US) 2008-09-17 CN 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 (5 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-20210154128-A1 FILM-FORMING COSMETIC COMPOSITION COMPRISING POLYURETHANE AND CROSS-LINKED STARCH CUTA, PUF60, PARG ALDH1A1 1816/4885TSHR 4186/4885TDP1 235/4885
US-11779534-B2 Film-forming cosmetic composition comprising polyurethane and cross-linked starch CUTA, PUF60, PARG ALDH1A1 1816/4885TSHR 4186/4885TDP1 235/4885
US-20080226569-A1 Polyurethane dispersions for use in personal care products C1R, PARN, DUOX2 ALDH1A1 483/4885TSHR 1769/4885TDP1 514/4885
US-20090041689-A1 POLYURETHANE DISPERSIONS BASED ON POLYCARBONATE POLYOLS AND SUITABLE FOR USE IN PERSONAL CARE PRODUCTS PUF60, PARG, PCBP1 ALDH1A1 1710/4885TSHR 4622/4885TDP1 229/4885
US-20090022678-A1 POLYURETHANE DISPERSIONS FOR USE IN PERSONAL CARE PRODUCTS C1R, PARN, DUOX2 ALDH1A1 483/4885TSHR 1769/4885TDP1 514/4885

“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.