SCHEMBL637827

SCHEMBL637827

CC(OC(=O)NCCC(C(=O)OCc1ccccc1)c1ccc(Cl)cc1)OC(=O)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.42
CTSK P43235 1/20 0.40
TP53 P04637 1/20 0.40
PRKCA P17252 1/20 0.39
PRKCD Q05655 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
SLC1A3 P43003 1/20 0.38
SLC1A1 P43005 1/20 0.38
ELANE P08246 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CCR1 P32246 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CNR1 P21554 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37

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
SCHEMBL638699 0.89 UTS2R (0.44) UTS2RCTSKTP53MMP2MMP9
SCHEMBL2234068 0.87 UTS2R (0.42) UTS2RCTSKTP53MMP2MMP9
SCHEMBL637745 0.87 UTS2R (0.42) UTS2RCTSKTP53MMP2MMP9
SCHEMBL638130 0.86 UTS2R (0.42) UTS2RCTSKTP53MMP2MMP9
SCHEMBL915624 0.86 PRKCA (0.42) UTS2RCTSKTP53PRKCAPRKCD
SCHEMBL638158 0.86 UTS2R (0.46) UTS2RCTSKTP53MMP2MMP9
SCHEMBL639258 0.85 UTS2R (0.45) UTS2RCTSKTP53MMP2MMP9
SCHEMBL917116 0.84 SYK (0.50) UTS2RCTSKTP53MMP2MMP9
SCHEMBL915922 0.83 UTS2R (0.44) UTS2RCTSKTP53MMP2MMP9
SCHEMBL639637 0.83 MEN1 (0.41) UTS2RCTSKTP53MMP2MMP9

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
EP-1660440-B1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT INC (US) 2012-02-22 EP disclosed