SCHEMBL7709855

SCHEMBL7709855

OCC1CCOC2(CCCCC2)OC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
HTR1A P08908 1/20 0.33
PABPC1 P11940 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL712028 0.86 PABPC1 (0.36) GAAHTR1APABPC1CTDSP1ALDH1A1
SCHEMBL714295 0.84 PABPC1 (0.33) GAAHTR1APABPC1CTDSP1
SCHEMBL711781 0.80 APLNR (0.32) GAAPABPC1CTDSP1
SCHEMBL16784817 0.79 ALDH1A1 (0.36) GAAALDH1A1
SCHEMBL8382509 0.75 GAA (0.34) GAAHTR1APABPC1CTDSP1
SCHEMBL13724095 0.75
SCHEMBL712250 0.72 GAA (0.32) GAA
SCHEMBL51112 0.71 GPR119 (0.34) ALDH1A1
SCHEMBL337849 0.71 APLNR (0.33)
SCHEMBL13381236 0.70 PABPC1 (0.40) GAAHTR1APABPC1CTDSP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5864046-A 9-hydroxymethyl-7,12-dioxaspiro 5,6!dodecane, 9-(2-hydroxyethyl)-7,11-dioxaspiro 5,5!undecane and a process for preparing said 9-(2-hydroxyethyl)-7,11-dioxaspiro 5,5!undecane COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1999-01-26 US claimed
JP-2002255950-A METHOD FOR PRODUCING 3-HYDROXYMETHYL TETRAHYDROFURAN COUNCIL SCIENT IND RES 2002-09-11 JP disclosed
US-6355814-B1 REACTING 9-HYDROXYMETHYL-7,12-DIOXASPIRO DODECANE WITH ALCOHOL AT 100-140 DEGREES C. FOR 1-4 HOURS IN PRESENCE OF ACID CATALYST, RECOVERING PRODUCT COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH OF INDIA (IN) 2002-03-12 US disclosed
US-6355814-B1 REACTING 9-HYDROXYMETHYL-7,12-DIOXASPIRO DODECANE WITH ALCOHOL AT 100-140 DEGREES C. FOR 1-4 HOURS IN PRESENCE OF ACID CATALYST, RECOVERING PRODUCT COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH OF INDIA (IN) 2002-03-12 US disclosed
US-5864046-A 9-hydroxymethyl-7,12-dioxaspiro 5,6!dodecane, 9-(2-hydroxyethyl)-7,11-dioxaspiro 5,5!undecane and a process for preparing said 9-(2-hydroxyethyl)-7,11-dioxaspiro 5,5!undecane COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1999-01-26 US disclosed
US-5864046-A 9-hydroxymethyl-7,12-dioxaspiro 5,6!dodecane, 9-(2-hydroxyethyl)-7,11-dioxaspiro 5,5!undecane and a process for preparing said 9-(2-hydroxyethyl)-7,11-dioxaspiro 5,5!undecane COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1999-01-26 US disclosed
US-5728848-A 9-hydroxymethyl-7,12 dioxaspiro 5,6!dodecane, novel 9-(2-hydroxyethyl-7,11-dioxaspiro 5,5!undecane and a process for preparing said 9-(2-hydroxyethyl-7,11 dioxaspiro 5,5!undecane COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1998-03-17 US disclosed
US-5728848-A 9-hydroxymethyl-7,12 dioxaspiro 5,6!dodecane, novel 9-(2-hydroxyethyl-7,11-dioxaspiro 5,5!undecane and a process for preparing said 9-(2-hydroxyethyl-7,11 dioxaspiro 5,5!undecane COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1998-03-17 US disclosed