SCHEMBL3264898

SCHEMBL3264898

CC1CC2(CC(=O)OC2=O)O1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL9644649 0.79
SCHEMBL7153017 0.75
SCHEMBL1078303 0.72
SCHEMBL3236128 0.69 LMNA (0.31)
SCHEMBL13515263 0.67 SMN1; SMN2 (0.33) SMN1; SMN2CA1CA9
SCHEMBL13059648 0.63
SCHEMBL237697 0.62
SCHEMBL4163556 0.62 TP53 (0.34) SMN1; SMN2
SCHEMBL6525946 0.62 TP53 (0.32) SMN1; SMN2CA1CA9
SCHEMBL16405076 0.61 TSHR (0.35)

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-1534216-B1 COMPOSITIONS COMPRISING ENCAPSULATED MATERIAL GIVAUDAN SA (CH) 2017-01-04 EP disclosed
US-7799752-B2 Compositions comprising encapsulated material QUEST INTERNATIONAL SERVICES B.V. (NL) 2010-09-21 US disclosed
US-20060039934-A1 Compositions comprising encapsulated material QUEST INTERNATIONAL SERVICES B.V. (NL) 2006-02-23 US disclosed