1,6-Hexanediol

1,6-Hexanediol

SCHEMBL28844927

CCC(C)(O)O.OCCCCCCO

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
TSHR P16473 2/20 0.53
HSD17B10 Q99714 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.47
CYP4F2 P78329 3/20 0.40
CYP4A11 Q02928 3/20 0.40
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 2/20 0.35
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
1,4-Butanediol SCHEMBL28558863 0.97 SMN1; SMN2 (0.50) ALDH1A1LMNATSHRHSD17B10MEN1
1,6-Hexanediol SCHEMBL10533782 0.84 ALDH1A1 (0.56) ALDH1A1LMNATSHRHSD17B10MEN1
1,6-Hexanediol SCHEMBL27381760 0.83 ALDH1A1 (0.53) ALDH1A1LMNATSHRHSD17B10MEN1
Ethylene Glycol SCHEMBL3897568 0.83 TSHR (0.40) ALDH1A1LMNATSHRHSD17B10MEN1
1,5-Pentanediol SCHEMBL8907420 0.80 ALDH1A1 (0.46) ALDH1A1LMNATSHRHSD17B10MEN1
Alcohol SCHEMBL23162490 0.79
1,6-Hexanediol SCHEMBL27903227 0.79 TSHR (0.56) ALDH1A1LMNATSHRHSD17B10MEN1
SCHEMBL40253 0.79
SCHEMBL12819894 0.79 TSHR (0.50) ALDH1A1TSHRTDP1
SCHEMBL9930783 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106832185-B Epoxy-capped polyurethane resin of use for synthetic leather large arch dam and preparation method thereof 上海华峰材料科技研究院(有限合伙) 2019-06-07 CN claimed
CN-106832185-A Epoxy-capped polyurethane resin of use for synthetic leather large arch dam and preparation method thereof 上海华峰材料科技研究院(有限合伙) 2017-06-13 CN claimed