SCHEMBL5504827

SCHEMBL5504827

CC(C)c1c([N+](=O)[O-])cc2c(c1F)NC(=O)C2

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 4/20 0.36
PGR P06401 3/20 0.34
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
ATM Q13315 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GRIA1 P42261 1/20 0.30
CACNG8 Q8WXS5 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
SCHEMBL5499002 0.82 TDP2 (0.38) TDP2PGRCYP11B1CYP11B2TDP1
SCHEMBL5502610 0.78 TDP2 (0.36) TDP2PGRCYP11B1CYP11B2TDP1
SCHEMBL5502292 0.77 AHR (0.32) TDP2GRIA1CACNG8
SCHEMBL5499274 0.76 TDP2 (0.35) TDP2PGRCYP11B1CYP11B2TDP1
SCHEMBL5503483 0.76 TDP2 (0.36) TDP2PGRCYP11B1CYP11B2
SCHEMBL5498328 0.75 TDP2 (0.35) TDP2PGRCYP11B1CYP11B2
SCHEMBL3139883 0.74 TDP2 (0.41) TDP2PGRCYP11B1CYP11B2ATM
SCHEMBL5504412 0.73 TDP2 (0.34) TDP2PGRCYP11B1CYP11B2
SCHEMBL19737628 0.71 GPR35 (0.44) TDP2PGRCYP11B1CYP11B2TDP1
SCHEMBL4661785 0.70 PGR (0.43) TDP2PGRGRIA1CACNG8

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869030-A1 7-FLUORO-1,3-DIHYDRO-INDOL-2-ONE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-12-26 EP disclosed
EP-1781642-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
EP-1781643-A1 OXINDOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
WO-2006106427-A1 7-FLUORO-1,3-DIHYDRO-INDOL-2-ONE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-12 WO disclosed
WO-2006016220-A1 OXINDOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed
WO-2006016221-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed