SCHEMBL5508737

SCHEMBL5508737

O=C1Cc2cc([N+](=O)[O-])c(CCF)cc2N1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.41
TDP2 O95551 3/20 0.37
AHR P35869 4/20 0.36
CMA1 P23946 2/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
EIF2AK2 P19525 1/20 0.35
MAOB P27338 2/20 0.34
GAA P10253 1/20 0.34
BCL6 P41182 1/20 0.34
BCOR Q6W2J9 1/20 0.34
KIF11 P52732 1/20 0.33
PDK2 Q15119 1/20 0.33
SMYD3 Q9H7B4 1/20 0.32
POLB P06746 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32

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
SCHEMBL5498169 0.86 PGR (0.41) PGRTDP2AHRCMA1PDE3B
SCHEMBL5502223 0.85 PGR (0.45) PGRTDP2AHRCMA1PDE3B
SCHEMBL5501521 0.80 PGR (0.40) PGRTDP2AHRCMA1EIF2AK2
SCHEMBL5504031 0.80 ALOX15 (0.41) PGRTDP2AHRCMA1EIF2AK2
SCHEMBL31726677 0.78 PGR (0.46) PGRTDP2AHRCMA1PDE3B
SCHEMBL5503888 0.77 AHR (0.39) PGRAHRCMA1PDE3BPDE3A
SCHEMBL9835657 0.75 PGR (0.46) PGRTDP2AHRCMA1PDE3B
SCHEMBL4507222 0.75 MAPT (0.49) PGRTDP2AHRCMA1PDE3B
SCHEMBL9832978 0.75 PGR (0.46) PGRTDP2AHRCMA1EIF2AK2
SCHEMBL31727303 0.75 MAPT (0.49) PGRTDP2AHRCMA1PDE3B

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-1781642-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
WO-2006016221-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed