SCHEMBL16709999

SCHEMBL16709999

CC1(C)CCCC(C)(C)C1NO

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 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
SCHEMBL3697329 0.73 CYP3A4 (0.41) CYP3A4MAPTRECQL
Alcohol SCHEMBL14109737 0.70 UGT2B7 (0.33)
SCHEMBL8906299 0.67 CYP3A4 (0.37) CYP3A4MAPTRECQL
Alcohol SCHEMBL14108686 0.65 UGT2B7 (0.30)
Alcohol SCHEMBL14109042 0.64
SCHEMBL5353766 0.63 CYP3A4 (0.33) CYP3A4MAPTRECQL
SCHEMBL4692464 0.61 CYP3A4 (0.32) CYP3A4MAPTRECQL
SCHEMBL29644917 0.61 CYP3A4 (0.32) CYP3A4MAPTRECQL
SCHEMBL21279730 0.61 CYP3A4 (0.32) CYP3A4MAPTRECQL
SCHEMBL19738024 0.61 CYP3A4 (0.32) CYP3A4MAPTRECQL

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-20150132667-A1 Secondary Battery MURATA MANUFACTURING CO., LTD. (JP) 2015-05-14 US disclosed