1,6-Hexanediol

1,6-Hexanediol

SCHEMBL9719735

N=C=O.N=C=O.N=C=O.OCCCCCCO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.43
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MIF P14174 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.35
CAMK2A Q9UQM7 1/20 0.33
FNTA P49354 1/20 0.32
FNTB P49356 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
1,5-Pentanediol SCHEMBL28700358 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL28339995 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL28102133 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
1,6-Hexanediol SCHEMBL6804695 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
1,6-Hexanediol SCHEMBL5188824 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
1,4-Butanediol SCHEMBL4274507 0.96 SMN1; SMN2 (0.39) GPR84FFAR1FFAR4LMNAALDH1A1
1,4-Butanediol SCHEMBL7139299 0.96
1,4-Butanediol SCHEMBL10871697 0.93 SMN1; SMN2 (0.37) GPR84FFAR1FFAR4LMNAALDH1A1
1,4-Butanediol SCHEMBL28233621 0.93 SMN1; SMN2 (0.37) GPR84FFAR1FFAR4LMNAALDH1A1
1,3-Propanediol SCHEMBL15655912 0.89 CAMK2A (0.35) GPR84FFAR1FFAR4LMNAALDH1A1

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
EP-0516697-A1 AMIDE-AMINE SILANE RESIN PPG INDUSTRIES, INC. (US) 1992-12-09 EP disclosed
WO-1991010697-A1 AMIDE-AMINE SILANE RESIN PPG INDUSTRIES, INC. (US) 1991-07-25 WO disclosed