1,6-Hexanediol

1,6-Hexanediol

SCHEMBL1005175

CC(O)CCC(C)O.OCCCCCCO

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.45
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.40
TRPV1 Q8NER1 1/20 0.38
TRPA1 O75762 1/20 0.38
PSMD14 O00487 2/20 0.33
PLA2G1B P04054 2/20 0.33
MMP2 P08253 2/20 0.33
ATG4B Q9Y4P1 2/20 0.33
HSP90AA1 P07900 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
RAD52 P43351 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL11099981 1.00 TSHR (0.45) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL8077217 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL5398466 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL428372 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL554360 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
1,6-Hexanediol SCHEMBL15347446 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL13202549 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL10406986 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL830579 0.91 LMNA (0.43) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL19411359 0.91 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011011675-A1 PHARMACEUTICALLY ACCEPTABLE FORMULATIONS/COMPOSITIONS FOR PEPTIDYL DRUGS ZELOS THERAPEUTICS, INC. (US) 2011-01-27 WO claimed
US-20140357806-A1 THERMAL-RESPONSIVE POLYMER NETWORKS, COMPOSITIONS, AND METHODS AND APPLICATIONS RELATED THERETO UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2014-12-04 US disclosed
WO-2011011675-A1 PHARMACEUTICALLY ACCEPTABLE FORMULATIONS/COMPOSITIONS FOR PEPTIDYL DRUGS ZELOS THERAPEUTICS, INC. (US) 2011-01-27 WO disclosed
WO-2002051395-A1 TREATMENT OF NEURODEGENERATIVE DISEASES CODON PHARMACEUTICALS, INC. (US) 2002-07-04 WO disclosed
US-4505981-A Heat-hardenable binder mixture BASF FARBEN & FASERN AG (DE) 1985-03-19 US disclosed