SCHEMBL11522377

SCHEMBL11522377

NC(=O)C(NC(=O)OCc1ccccc1)c1cccc(O)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.54
PPARG P37231 1/20 0.54
CTSL P07711 1/20 0.53
CTSS P25774 1/20 0.53
KLK8 O60259 1/20 0.48
F2 P00734 1/20 0.48
F10 P00742 1/20 0.48
PLG P00747 1/20 0.48
PLAU P00749 1/20 0.48
PLAT P00750 1/20 0.48
KLK4 Q9Y5K2 1/20 0.48
KLK1 P06870 1/20 0.48

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
SCHEMBL17776392 0.89 ATM (0.65) ATMCTSLCTSSKLK8F2
SCHEMBL18925994 0.89 ATM (0.65) ATMCTSLCTSSKLK8F2
SCHEMBL11522376 0.87 CTSL (0.56) ATMPPARGCTSLCTSSKLK1
SCHEMBL16766403 0.79 ATM (0.62) ATMPPARGCTSLCTSS
SCHEMBL3255533 0.78 ATM (0.77) ATMPPARGCTSLCTSS
SCHEMBL7719287 0.78 ATM (0.77) ATMPPARGCTSLCTSS
SCHEMBL1362502 0.78 ATM (0.77) ATMPPARGCTSLCTSS
SCHEMBL434233 0.78 ATM (0.77) ATMPPARGCTSLCTSS
SCHEMBL9457091 0.78 ATM (0.76) ATMPPARGCTSLCTSS
SCHEMBL9457096 0.78 ATM (0.76) ATMPPARGCTSLCTSS

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-4144391-A REPLACING AN ACETOXY GROUP BY A SULFUR NUCLEOPHILE ELI LILLY AND COMPANY (US) 1979-03-13 US disclosed