SCHEMBL1534444

SCHEMBL1534444

CCP(=O)(O)ONC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.33
MMP2 P08253 4/20 0.33
MMP3 P08254 2/20 0.33
MMP9 P14780 2/20 0.33
MMP8 P22894 2/20 0.33
PLA2G2A P14555 1/20 0.32
PPARD Q03181 1/20 0.31
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
LAP3 P28838 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
SCHEMBL25232258 0.79 ALDH1A1 (0.32) LAP3
SCHEMBL28358680 0.75
SCHEMBL28432765 0.75 TSHR (0.35) LAP3
SCHEMBL11302315 0.75 SLC15A1 (0.37) MMP1MMP2MMP3LAP3
SCHEMBL8520668 0.74 PPARD (0.38) MMP1MMP2MMP3MMP9MMP8
SCHEMBL4970385 0.74 CA1 (0.37) CA12CA1CA2
SCHEMBL10452225 0.73
SCHEMBL2776800 0.71
SCHEMBL19348597 0.71
SCHEMBL11899217 0.71 TSHR (0.50) MMP1MMP2PLA2G2APPARDCA12

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-2011038158-A2 METHODS, COMPOSITIONS, SYSTEMS AND APPARATUS FOR MOLECULAR ARRAY FABRICATION Life Technologies Corporation (US) 2011-03-31 WO disclosed