SCHEMBL8893717

SCHEMBL8893717

CC1(c2ccc(OCc3ncon3)cc2)OC(=O)N(Nc2ccccc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 2/20 0.36
MMP2 P08253 2/20 0.33
MMP13 P45452 1/20 0.33
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
MMP9 P14780 1/20 0.32
ADAM17 P78536 1/20 0.32
BACE1 P56817 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
LMNA P02545 1/20 0.31
SMPD1 P17405 1/20 0.30

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
SCHEMBL9545815 0.82 MAOB (0.42) SIRT1MMP2MMP13ALDH1A1ADAM17
SCHEMBL8893376 0.81 SIRT1 (0.41) SIRT1MMP2MMP13MMP9ADAM17
SCHEMBL9202236 0.81 SIRT1 (0.37) SIRT1MMP2MMP13ALDH1A1GAA
SCHEMBL8892271 0.81 LMNA (0.52) ALDH1A1GAALMNA
SCHEMBL8893414 0.80 ADAM17 (0.36) SIRT1MMP2MMP13ALDH1A1MMP9
SCHEMBL8903156 0.80 L3MBTL1 (0.46) SIRT1MMP2MMP13ALDH1A1LMNA
SCHEMBL8892678 0.80 SIRT1 (0.36) SIRT1MMP2MMP13ALDH1A1GAA
SCHEMBL9207805 0.79 RAB9A (0.40) SIRT1MMP2MMP13
SCHEMBL8902040 0.79 SIRT1 (0.38) SIRT1MMP2MMP13GAAMMP9
Famoxadone SCHEMBL673443 0.79 MMP2 (0.42) SIRT1MMP2MMP13ALDH1A1MMP9

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
WO-1997038997-A1 SUBSTITUTED OXAZOLIDINEDIONES AND THEIR USE AS FUNGICIDES ZENECA LIMITED (GB) 1997-10-23 WO disclosed