SCHEMBL5505345

SCHEMBL5505345

CCCN1C(=O)C([Fe])c2cc(N)cc(F)c21

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.36
PGR P06401 1/20 0.32
CNR2 P34972 3/20 0.31
CNR1 P21554 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
SCHEMBL5511211 0.81
SCHEMBL5501428 0.74 CYP19A1 (0.31) CYP19A1
SCHEMBL5505355 0.74 CYP19A1 (0.43) CYP19A1CNR2CNR1
SCHEMBL5001377 0.70 CYP19A1 (0.38) CYP19A1PGR
SCHEMBL5505340 0.69 CYP19A1 (0.37) CYP19A1PGR
SCHEMBL18571340 0.67 HTT (0.34) CYP19A1
SCHEMBL18571099 0.61 ALDH1A1 (0.35) CYP19A1PGR
SCHEMBL22540651 0.61
SCHEMBL4997606 0.60 ATAD2 (0.44) CYP19A1
SCHEMBL22540652 0.59 PGR (0.31) PGR

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-1781643-A1 OXINDOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
WO-2006016220-A1 OXINDOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed