SCHEMBL5502648

SCHEMBL5502648

Nc1cc2c(cc1C1CCC1)NC(=O)C2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.51
AHR P35869 4/20 0.40
CMA1 P23946 2/20 0.40
GRIA1 P42261 2/20 0.39
EIF2AK2 P19525 1/20 0.39
SMYD3 Q9H7B4 9/20 0.38
CACNG8 Q8WXS5 1/20 0.37
PDK2 Q15119 1/20 0.37
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
CA9 Q16790 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL5505557 0.93 EPHX2 (0.46) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL2491904 0.79 AHR (0.50) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL5506438 0.78 EPHX2 (0.46) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL2486755 0.73 GRIA1 (0.51) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL11106607 0.73 AHR (0.53) AHRCMA1GRIA1EIF2AK2SMYD3
SCHEMBL31010750 0.72 AHR (0.59) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL5499322 0.72 EPHX2 (0.39) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL5498091 0.71 PGR (0.43) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL5499457 0.70 AHR (0.42) EPHX2AHRCMA1GRIA1EIF2AK2
SCHEMBL153860 0.69 AHR (0.53) EPHX2AHRCMA1GRIA1EIF2AK2

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