SCHEMBL5483503

SCHEMBL5483503

Cc1c2nc3ccc(NC(=O)CCNC(=O)OC(C)(C)C)cc3oc-2c(C(=O)O)c(=O)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.41
SUV39H2 Q9H5I1 2/20 0.39
ABL1 P00519 1/20 0.39
PDGFRB P09619 1/20 0.39
SRC P12931 1/20 0.39
PDGFRA P16234 1/20 0.39
MAPK14 Q16539 1/20 0.39
LDHA P00338 2/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HIF1A Q16665 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 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
SCHEMBL1635348 0.93 SUV39H2 (0.40) ADORA3SUV39H2ABL1PDGFRBSRC
SCHEMBL1635346 0.86 KDM4E (0.41) ADORA3SUV39H2ABL1PDGFRBSRC
SCHEMBL1636865 0.80 KDM4E (0.41) ADORA3SUV39H2ABL1PDGFRBSRC
SCHEMBL1635427 0.77 TLR7 (0.41) ADORA3SUV39H2ABL1PDGFRBSRC
SCHEMBL1635253 0.71 TLR7 (0.41) ADORA3SUV39H2ABL1PDGFRBSRC
SCHEMBL1719827 0.70 POLB (0.45) KDM4EALDH1A1GLAGAAMAPT
Trifluoroacetic Acid SCHEMBL1636097 0.69 SMN1; SMN2 (0.45) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL2244763 0.68 ALDH1A1 (0.59) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL8692897 0.68 CA1 (0.66) SUV39H2ABL1PDGFRBSRCPDGFRA
SCHEMBL14911359 0.67 SMN1; SMN2 (0.64) KDM4EALDH1A1GAAMAPTCYP1A2

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
EP-1786828-A1 NOVEL ENZYMATIC SUBSTRATES DERIVED FROM PHENOXAZINONE AND THEIR USE AS DEVELOPER IN DETECTION OF MICRO-ORGANISM WITH PEPTIDASE ACTIVITY BIOMERIEUX (FR) 2007-05-23 EP disclosed
WO-2006030119-A1 NOVEL ENZYMATIC SUBSTRATES DERIVED FROM PHENOXAZINONE AND THEIR USE AS DEVELOPER IN DETECTION OF MICRO-ORGANISM WITH PEPTIDASE ACTIVITY bioMérieux (FR) 2006-03-23 WO disclosed