1,5-Pentanediol

1,5-Pentanediol

SCHEMBL6423642

CC(O)CCO.OCCCCCO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.38
THRB P10828 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
TRPA1 O75762 1/20 0.36
MIF P14174 1/20 0.33
PSMD14 O00487 2/20 0.32
PLA2G1B P04054 2/20 0.32
MMP2 P08253 2/20 0.32
ATG4B Q9Y4P1 2/20 0.32
HSP90AA1 P07900 1/20 0.32
RAD52 P43351 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
FFAR1 O14842 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
1,6-Hexanediol SCHEMBL2190350 1.00 TSHR (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
1,3-Butanediol SCHEMBL28244301 1.00 TSHR (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
1,3-Butanediol SCHEMBL8093341 0.97 TDP1 (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
1,3-Butanediol SCHEMBL1415145 0.97 TDP1 (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
1,3-Butanediol SCHEMBL3458713 0.91 TDP1 (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL11099981 0.91 TSHR (0.45) TSHRALDH1A1LMNAHSD17B10MEN1
1,6-Hexanediol SCHEMBL1005175 0.91 TSHR (0.45) TSHRALDH1A1LMNAHSD17B10MEN1
1,6-Hexanediol SCHEMBL9446135 0.90 THRB (0.48) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL5398466 0.88 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL554360 0.88 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1

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
US-8466254-B2 Polyester process XEROX CORPORATION (US) 2013-06-18 US claimed
CN-103999274-A Polyurethane-based electrode binder compositions and electrodes thereof for electrochemical cells LUBRIZOL ADVANCED MAT INC 2014-08-20 CN disclosed
EP-1208130-B1 PREPARATION OF POLY(TRIMETHYLENE TEREPHTHALATE) DU PONT (US) 2005-03-02 EP disclosed