SCHEMBL4744008

SCHEMBL4744008

CC(O)C(=O)ONC(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA9 Q16790 2/20 0.55
ATM Q13315 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
CTSL P07711 1/20 0.50
CTSS P25774 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CTSK P43235 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ELANE P08246 1/20 0.48
CTRB1 P17538 2/20 0.48
POLB P06746 1/20 0.47

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
SCHEMBL20299925 0.85 CA12 (0.52) CA12CA1CA2CA9ATM
SCHEMBL6703437 0.82 CTSK (0.54) CA12CA1CA2CA9CTSL
SCHEMBL1947879 0.82 ALDH1A1 (0.65) CA12CA1CA2CA9NPC1
SCHEMBL1287193 0.82 CA12 (0.52) CA12CA1CA2CA9ATM
SCHEMBL11100708 0.82 CA12 (0.63) CA12CA1CA2CA9NPC1
SCHEMBL201855 0.81 ALDH1A1 (0.62) ATMNPC1RAB9ACTSLCTSS
SCHEMBL1107604 0.81 ALDH1A1 (0.62) ATMNPC1RAB9ACTSLCTSS
SCHEMBL320610 0.81 ALDH1A1 (0.62) ATMNPC1RAB9ACTSLCTSS
SCHEMBL27577606 0.81 SIRT2 (0.51) CA12CA1CA2CA9CTSL
SCHEMBL4756378 0.81 CA12 (0.58) CA12CA1CA2CA9NPC1

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
WO-2008098396-A2 OXAZOLIDINONES AND THEIR USE AS HYPOCHOLESTEROLEMIC AGENTS LIPIDEON BIOTECHNOLOGY AG (CH) 2008-08-21 WO disclosed