SCHEMBL8990510

SCHEMBL8990510

CCC(CCl)OC(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
LMNA P02545 1/20 0.31
CA12 O43570 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP8 P22894 1/20 0.30
CA9 Q16790 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
SCHEMBL11261469 0.88 TSHR (0.33)
SCHEMBL305036 0.85 CTSK (0.40) CTSKCA1CA2CA12MMP1
SCHEMBL9048220 0.82 PRKCA (0.34)
SCHEMBL15503329 0.81 ENPP2 (0.32) CA1CA2LMNA
SCHEMBL11241345 0.80 AR (0.31)
SCHEMBL11369133 0.79 CA2 (0.44) CTSKCA1CA2
SCHEMBL10938384 0.79 MAPT (0.39) CTSKCA1CA2LMNACA12
SCHEMBL26399931 0.79
SCHEMBL575296 0.79
SCHEMBL1469110 0.77 ACACB (0.40) CTSKCA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587374-A BACTERICIDES TREATING INFECTIONS GLAXO SPA (IT) 1996-12-24 US disclosed
EP-0495953-B1 10-(1-Hydroxyethyl)-11-oxo-1-azatricyclo[7.2.0.0(3,8)]undec-2-ene-2-carboxylic acid esters and a process for preparing thereof GLAXO SPA (IT) 1994-06-08 EP disclosed