SCHEMBL6474979

SCHEMBL6474979

COc1cc(Cl)ccc1CC(=O)NC1(C(=O)O)CCCC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.51
SHMT1 P34896 2/20 0.48
SHMT2 P34897 2/20 0.48
GAA P10253 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 1/20 0.44
KDM4C Q9H3R0 1/20 0.43
FABP4 P15090 5/20 0.43
FABP5 Q01469 3/20 0.43
FFAR4 Q5NUL3 1/20 0.43

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
SCHEMBL6473570 0.99 LPAR1 (0.52) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6474884 0.99 LPAR1 (0.52) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6483723 0.99 LPAR1 (0.52) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6479971 0.91 MEN1 (0.44) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6483517 0.89 MEN1 (0.45) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6483239 0.89 MEN1 (0.45) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6475241 0.89 MEN1 (0.45) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6480025 0.89 GAA (0.44) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6474846 0.88 MEN1 (0.42) LPAR1SHMT1SHMT2GAAKDM4E
SCHEMBL6475688 0.87 MEN1 (0.42) LPAR1SHMT1SHMT2GAAKDM4E

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-6939888-B2 1-H-3-arylpirrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-09-06 US disclosed
US-6472419-B1 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives as pest-control agents BAYER AKTIENGESELLSCHAFT (DE) 2002-10-29 US disclosed