1,5-Pentanediol

1,5-Pentanediol

SCHEMBL8988957

O=CO.OCCCCCO

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.45
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.36
CAMK2A Q9UQM7 1/20 0.35
MIF P14174 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
CA2 P00918 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
GAA P10253 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 SCHEMBL28194476 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
Formic Acid SCHEMBL28554253 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
1,4-Butanediol SCHEMBL2165950 0.96
1,3-Propanediol SCHEMBL1399806 0.88
Octanol SCHEMBL28176901 0.85 TSHR (0.72) LMNAALDH1A1TSHRHSD17B10MEN1
1,6-Hexanediol SCHEMBL3387365 0.85 GPR84 (0.48) GPR84FFAR1FFAR4LMNAALDH1A1
Cetyl Alcohol SCHEMBL8359228 0.85 TSHR (0.72) LMNAALDH1A1TSHRHSD17B10MEN1
1-Hexanol SCHEMBL1047802 0.85 TSHR (0.72) LMNAALDH1A1TSHRHSD17B10MEN1
Tridecan-1-Ol SCHEMBL9863316 0.85 TSHR (0.72) LMNAALDH1A1TSHRHSD17B10MEN1
Ethylene Glycol SCHEMBL27361208 0.79 TSHR (0.50) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0719248-A1 SYNTHESIS OF SARCOSINATE SURFACTANTS THE PROCTER & GAMBLE COMPANY (US) 1996-07-03 EP disclosed
EP-0719249-A1 SYNTHESIS OF AMIDO ACIDS FROM CARBOXYLIC ACID ESTERS AND AMINO ACID SALTS THE PROCTER & GAMBLE COMPANY (US) 1996-07-03 EP disclosed
WO-1995007882-A1 SYNTHESIS OF AMIDO ACIDS FROM CARBOXYLIC ACID ESTERS AND AMINO ACID SALTS THE PROCTER & GAMBLE COMPANY (US) 1995-03-23 WO disclosed
WO-1995007881-A1 SYNTHESIS OF SARCOSINATE SURFACTANTS THE PROCTER & GAMBLE COMPANY (US) 1995-03-23 WO disclosed