SCHEMBL15340774

SCHEMBL15340774

COC(=O)C(C)C(CC(C)(C)C)C(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA14 Q9ULX7 3/20 0.33
MMP8 P22894 1/20 0.33
CA12 O43570 2/20 0.32
AR P10275 1/20 0.31
PIK3CD O00329 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL12135638 0.85 SMN1; SMN2 (0.41) SMN1; SMN2CA1CA2CA14MMP8
SCHEMBL5519045 0.85 SMN1; SMN2 (0.41) SMN1; SMN2CA1CA2CA14MMP8
SCHEMBL13385949 0.80 GAA (0.33) SMN1; SMN2CA1CA2CA14CA12
SCHEMBL5539779 0.76 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2CA14MMP8
SCHEMBL17236358 0.76 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2CA14MMP8
SCHEMBL8980146 0.76 CA1 (0.42) SMN1; SMN2CA1CA2CA14MMP8
SCHEMBL7955830 0.74 SMN1; SMN2 (0.38) SMN1; SMN2CA1CA2CA14MMP8
SCHEMBL11651911 0.72 TSHR (0.39) SMN1; SMN2CA1CA2CA14CA12
SCHEMBL12311399 0.72 MMP8 (0.33) SMN1; SMN2CA1CA2MMP8MEN1
SCHEMBL12050568 0.72 CA1 (0.33) SMN1; SMN2CA1CA2

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-20130281608-A1 USE OF BIOBASED SUGAR MONOMERS IN VINYL COPOLYMERS AS LATEX BINDERS AND COMPOSITIONS BASED THEREON ECOSYNTHETIX LTD. (US) 2013-10-24 US disclosed