SCHEMBL4870371

SCHEMBL4870371

CCC1CCC(C(C(=O)NNc2nccc(C)n2)N(O)C=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
SYK P43405 2/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 2/20 0.34
FASN P49327 1/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL4866392 0.89 POLB (0.36) POLBSYKLMNAKDM4EFASN
SCHEMBL4867317 0.88 HTT (0.40) POLBSYKLMNAKDM4EFASN
SCHEMBL6241915 0.87 GAA (0.39) SYKGAA
SCHEMBL4872289 0.87 GAA (0.39) SYKGAA
SCHEMBL4864188 0.85 SYK (0.36) POLBSYKLMNAKDM4EFASN
SCHEMBL4873664 0.84 KDM4E (0.36) POLBSYKLMNAKDM4EFASN
SCHEMBL4870898 0.83 POLB (0.36) POLBSYKLMNAKDM4EFASN
SCHEMBL4870528 0.76
SCHEMBL4864629 0.76 GAA (0.41) SYKGAA
SCHEMBL4867247 0.75 SYK (0.38) SYKALDH1A1HPGD

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
US-7332485-B2 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP (US) 2008-02-19 US disclosed