SCHEMBL8527748

SCHEMBL8527748

CCC1COC2(CCC(C(C)(C)C)CC2)O1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
GAA P10253 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 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
SCHEMBL9678068 0.89 PABPC1 (0.32) PABPC1CTDSP1
SCHEMBL8798930 0.86 PABPC1 (0.36) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL9203504 0.86 PABPC1 (0.36) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL8878463 0.86 PABPC1 (0.36) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL11170793 0.85 ALDH1A1 (0.33) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL9831774 0.83 PABPC1 (0.34) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL9749043 0.83 PABPC1 (0.34) PABPC1CTDSP1GAA
SCHEMBL9742001 0.83 PABPC1 (0.34) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL9742721 0.83 PABPC1 (0.34) PABPC1CTDSP1GAACYP1A2CYP2D6
SCHEMBL12532487 0.83 PABPC1 (0.32) PABPC1CTDSP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0616994-B1 Process for producing ether alcohols by hydrogenolysis of cyclic ketal KAO CORP (JP) 1998-12-30 EP disclosed
US-5446208-A Process for producing ether alcohols by hydrogenolysis of cyclic ketal KAO CORPORATION (JP) 1995-08-29 US disclosed
EP-0616994-A2 Process for producing ether alcohols by hydrogenolysis of cyclic ketal KAO CORPORATION (JP) 1994-09-28 EP disclosed