SCHEMBL8911892

SCHEMBL8911892

Cc1c(NC(=O)NC(C)C)sc2nc([C@H](C)NC(=O)OCc3ccccc3)oc(=O)c12

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
NPSR1 Q6W5P4 1/20 0.42
TOP2A P11388 1/20 0.38
TOP2B Q02880 1/20 0.38

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
SCHEMBL8911899 1.00 ATM (0.52) ATMNPSR1TOP2ATOP2B
SCHEMBL8912014 0.92 ATM (0.51) ATMNPSR1
SCHEMBL8912021 0.92 ATM (0.51) ATMNPSR1
SCHEMBL8913775 0.92 ATM (0.50) ATM
SCHEMBL8913766 0.92 ATM (0.50) ATM
SCHEMBL8911363 0.90 ATM (0.53) ATMNPSR1
SCHEMBL8912043 0.90 ATM (0.53) ATMNPSR1
SCHEMBL8911359 0.90 ATM (0.53) ATMNPSR1
SCHEMBL8912049 0.90 ATM (0.53) ATMNPSR1
SCHEMBL8911408 0.89 ATM (0.47) ATMNPSR1

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
EP-0799230-A1 THIENOXAZINONE DERIVATIVES USEFUL AS ANTIVIRAL AGENTS SMITHKLINE BEECHAM PLC (GB) 1997-10-08 EP disclosed
WO-1996019482-A1 THIENOXAZINONE DERIVATIVES USEFUL AS ANTIVIRAL AGENTS SMITHKLINE BEECHAM PLC (GB) 1996-06-27 WO disclosed