1,6-Hexanediol

1,6-Hexanediol

SCHEMBL29137905

C=C(C)C(=O)O.C=C(C)C(=O)OCCO.OCCCCCCO

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.55
THRB P10828 1/20 0.47
POLB P06746 1/20 0.45
APEX1 P27695 1/20 0.45
HTT P42858 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GPR84 Q9NQS5 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
ACHE P22303 7/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 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
Methacrylic Acid SCHEMBL9420076 0.93 TSHR (0.65) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL28083701 0.93 TSHR (0.65) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL28451362 0.93 TSHR (0.65) TSHRTHRBPOLBAPEX1HTT
1,4-Butanediol SCHEMBL1696574 0.92 TSHR (0.57) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL9453862 0.92 THRB (0.53) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL467445 0.92 THRB (0.53) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL28280981 0.91 TSHR (0.61) TSHRTHRBPOLBAPEX1HTT
SCHEMBL905326 0.91 TSHR (0.67) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL29350265 0.90 THRB (0.57) TSHRTHRBPOLBAPEX1HTT
Methacrylic Acid SCHEMBL7623072 0.90 THRB (0.52) TSHRTHRBPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117338611-A Low-odor visible light curing crystal liquid and preparation method and application thereof 烟台冠宏新材料有限公司 2024-01-05 CN disclosed