1,6-Hexanediol

1,6-Hexanediol

SCHEMBL2954036

CC(C)(C)c1cc(CCC(=O)O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CCC(=O)O)c(O)c(C(C)(C)C)c1.OCCCCCCO

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
NR5A2 O00482 1/20 0.40
NR5A1 Q13285 1/20 0.40
VCAM1 P19320 5/20 0.40
NPSR1 Q6W5P4 3/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 1/20 0.38
XBP1 P17861 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
CYP2C19 P33261 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
GLRA3 O75311 1/20 0.37
GLRB P48167 1/20 0.37

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
Cetostearyl Alcohol SCHEMBL27886170 0.95 NR5A2 (0.45) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL27949727 0.92 NR1H4 (0.37) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL30206727 0.92 NR1H4 (0.48) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL265814 0.92 NR1H4 (0.48) NR1H4RXRARXRBRXRGNR5A2
Ethane SCHEMBL19639572 0.90 NR1H4 (0.47) NR1H4RXRARXRBRXRGNR5A2
Hydrogen Sulfide SCHEMBL28833668 0.90 NR1H4 (0.47) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL27965252 0.89 NR5A2 (0.49) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL2022443 0.88 NR1H4 (0.43) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL5607798 0.88 NR1H4 (0.43) NR1H4RXRARXRBRXRGNR5A2
SCHEMBL27755263 0.88 NR1H4 (0.43) NR1H4RXRARXRBRXRGNR5A2

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
US-7749579-B2 Rolled optical film KONICA MINOLTA OPTO, INC. (JP) 2010-07-06 US disclosed
US-20070128381-A1 ROLLED OPTICAL FILM KONICA MINOLTA OPTO, INC. (JP) 2007-06-07 US disclosed