1,6-Hexanediol

1,6-Hexanediol

SCHEMBL5422191

O=C(CCN1CC1)OCCCCCCOC(=O)CCN1CC1.OCCCCCCO

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.40
THRB P10828 4/20 0.39
THRA P10827 3/20 0.39
HTR2C P28335 1/20 0.37
NAAA Q02083 1/20 0.36
DGKA P23743 1/20 0.36
PAOX Q6QHF9 1/20 0.36
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC29A1 Q99808 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL17466530 0.95 TP53 (0.38) ACHETHRBTHRAGAAMEN1
SCHEMBL24575293 0.93 SMN1; SMN2 (0.37) ACHETHRBTHRADGKAPAOX
SCHEMBL5421607 0.93 THRB (0.42) THRBTHRAHTR2CNAAADGKA
SCHEMBL820593 0.91 THRB (0.40) ACHETHRBTHRAHTR2CNAAA
SCHEMBL30917891 0.85 SMN1; SMN2 (0.39) THRBTHRAMEN1TP53KMT2A
SCHEMBL18154851 0.85 SMN1; SMN2 (0.39) THRBTHRAMEN1TP53KMT2A
SCHEMBL4979398 0.84 NAAA (0.56) THRBTHRAHTR2CNAAADGKA
SCHEMBL11711713 0.84 NAAA (0.56) THRBTHRAHTR2CNAAADGKA
SCHEMBL17466531 0.83 SMN1; SMN2 (0.38) ACHENAAASMN1; SMN2
SCHEMBL673537 0.82 ALDH1A1 (0.44) THRBTHRADGKAPAOXTP53

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
US-20070066709-A1 Manufacturing method for ambient temperature self-curable system of water borne-based polymeric ink TAMKANG UNIVERSITY (TW) 2007-03-22 US disclosed