1,6-Hexanediol

1,6-Hexanediol

SCHEMBL7071741

O=C1CCCN1.OCCCCCCO

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.65
CRBN Q96SW2 3/20 0.56
FKBP5 Q13451 1/20 0.56
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
POLB P06746 1/20 0.40
HLCS P50747 1/20 0.31
ALOX5 P09917 2/20 0.30
LMNA P02545 1/20 0.30
PGR P06401 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
MAOA P21397 1/20 0.30
TBXA2R P21731 1/20 0.30
MAPK1 P28482 1/20 0.30
AVPR2 P30518 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTR2B P41595 1/20 0.30

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
2-Pyrrolidone SCHEMBL28324136 0.93 OR51E2 (0.68) OR51E2CRBNFKBP5KDM4EGAA
Caprolactam SCHEMBL28279866 0.92 CRBN (0.64) OR51E2CRBNFKBP5KDM4EGAA
Decanol SCHEMBL4969999 0.91 OR51E2 (0.54) OR51E2CRBNFKBP5KDM4EGAA
Dodecanol SCHEMBL27629045 0.91 OR51E2 (0.54) OR51E2CRBNFKBP5KDM4EGAA
2-Pyrrolidone SCHEMBL6003660 0.89 OR51E2 (0.75) OR51E2CRBNFKBP5KDM4EGAA
2-Pyrrolidone SCHEMBL27512532 0.89 OR51E2 (0.75) OR51E2CRBNFKBP5KDM4EGAA
2-Pyrrolidone SCHEMBL9303170 0.89 OR51E2 (0.75) OR51E2CRBNFKBP5KDM4EGAA
1-Pentanol SCHEMBL28143808 0.88 OR51E2 (0.56) OR51E2CRBNFKBP5KDM4EGAA
2-Pyrrolidone SCHEMBL9016114 0.86 OR51E2 (0.71) OR51E2CRBNFKBP5KDM4EGAA
2-Pyrrolidone SCHEMBL28259292 0.86 OR51E2 (0.58) OR51E2CRBNFKBP5KDM4EGAA

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
EP-0715726-B1 POLYMER MICROSTRUCTURES WHICH FACILITATE FIBER OPTIC TO WAVEGUIDE COUPLING CORNING INC (US) 2003-12-10 EP disclosed