1,5-Pentanediol

1,5-Pentanediol

SCHEMBL484472

CCC(CO)(CO)CO.OCCCCCO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TSHR P16473 3/20 0.50
LMNA P02545 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.36
CYP4F2 P78329 2/20 0.34
CYP4A11 Q02928 2/20 0.34
GPR84 Q9NQS5 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL6673802 1.00 ALDH1A1 (0.50) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL28113712 1.00 ALDH1A1 (0.50) ALDH1A1TSHRLMNAHSD17B10MEN1
1,6-Hexanediol SCHEMBL2733820 1.00 ALDH1A1 (0.50) ALDH1A1TSHRLMNAHSD17B10MEN1
1,6-Hexanediol SCHEMBL10441623 0.97 ALDH1A1 (0.48) ALDH1A1TSHRLMNAHSD17B10MEN1
1,4-Butanediol SCHEMBL6034635 0.97 SMN1; SMN2 (0.47) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL21409482 0.94 ALDH1A1 (0.50) ALDH1A1TSHRLMNAHSD17B10MEN1
Octanol SCHEMBL28203059 0.92 LMNA (0.65) ALDH1A1TSHRLMNAHSD17B10MEN1
Dodecanol SCHEMBL27628573 0.92 LMNA (0.65) ALDH1A1TSHRLMNAHSD17B10MEN1
1,5-Pentanediol SCHEMBL8982038 0.88 LMNA (0.40) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL8369170 0.87 LMNA (0.43) ALDH1A1TSHRLMNAHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411433-A1 POLYURETHANES, ARTICLES AND COATINGS PREPARED THEREFROM AND METHODS OF MAKING THE SAME PPG Industries Ohio, Inc. (US) 2012-02-01 EP disclosed
WO-2010110784-A1 POLYURETHANES, ARTICLES AND COATINGS PREPARED THEREFROM AND METHODS OF MAKING THE SAME PPG INDUSTRIES OHIO, INC. (US) 2010-09-30 WO disclosed
US-5563223-A CURABLE POLYESTER; FILM HAVING SUPERIOR HARDNESS, ANTISOILANT, WEATHERPROOFING, RESISTANCE TO STAINING BY FOOD-STUFF, BOILING WATER AND CORROSION RESISTANCE TOYO BOSEKI KABUSHIKI KAISHA (JP) 1996-10-08 US disclosed