SCHEMBL8553756

SCHEMBL8553756

Cc1ccc(CC(=O)NC(C)C(=O)O)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SHMT1 P34896 3/20 0.45
SHMT2 P34897 3/20 0.45
HSD17B10 Q99714 1/20 0.44
PSMB5 P28074 2/20 0.41
PSMB8 P28062 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGS2 P35354 2/20 0.39
GAA P10253 1/20 0.39
CNR2 P34972 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL8553759 1.00 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2SHMT1SHMT2
SCHEMBL8557083 0.86 GAA (0.46) ALDH1A1MEN1KMT2APTGS2GAA
SCHEMBL8656928 0.86 GAA (0.46) ALDH1A1MEN1KMT2APTGS2GAA
SCHEMBL8556995 0.86 SDCBP (0.47) ALDH1A1HSD17B10PSMB5PSMB8CA1
SCHEMBL8556999 0.86 SDCBP (0.47) ALDH1A1HSD17B10PSMB5PSMB8CA1
SCHEMBL8556439 0.85 ALDH1A1 (0.54) KDM4EALDH1A1CA1CA2
SCHEMBL8556435 0.85 ALDH1A1 (0.54) KDM4EALDH1A1CA1CA2
SCHEMBL8556273 0.84 CA2 (0.46) KDM4EALDH1A1MEN1KMT2ACA1
SCHEMBL8556276 0.84 CA2 (0.46) KDM4EALDH1A1MEN1KMT2ACA1
SCHEMBL4426812 0.83 PRSS1 (0.48) KDM4EALDH1A1SMN1; SMN2SHMT1SHMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847211-A Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0668267-B1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1998-04-08 EP disclosed
US-5622917-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed
EP-0668267-A1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1995-08-23 EP disclosed