SCHEMBL7802900

SCHEMBL7802900

Cn1c(OC(=O)O)cc(=O)n(C)c1=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.50
MAPT P10636 2/20 0.49
HTT P42858 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 7/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
BRCA1 P38398 1/20 0.38
CASP7 P55210 1/20 0.38
RAB9A P51151 3/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
NPC1 O15118 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
SCHEMBL6802246 0.69 MAPT (0.58) MAPTHTTKDM4EALDH1A1NPSR1
SCHEMBL3806352 0.66 MAPT (0.44) PLA2G7MAPTHTTKDM4EALDH1A1
SCHEMBL4198025 0.66 MCL1 (0.57) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL12929340 0.65 NPSR1 (0.68) MAPTHTTALDH1A1NPSR1KMT2A
SCHEMBL689438 0.65 HPGD (0.35) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL91340 0.63 ALDH1A1 (0.45) PLA2G7MAPTHTTKDM4EALDH1A1
SCHEMBL9243614 0.62 KDM4E (0.60) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9242590 0.62 RXFP1 (0.52) KMT2AMEN1
SCHEMBL3229953 0.62 MAPT (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL9819131 0.61 GLA (0.31) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796251-B1 URACIL DERIVATIVES BYK GULDEN LOMBERG CHEM FAB (DE) 2001-10-17 EP disclosed
EP-0796251-A1 URACIL DERIVATIVES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1997-09-24 EP disclosed
WO-1996017831-A1 URACIL DERIVATIVES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-06-13 WO disclosed