SCHEMBL3488066

SCHEMBL3488066

O=C(Nc1nc2c(c(=O)[nH]1)NC(C(=O)OCC1c3ccccc3-c3ccccc31)=[N+]2)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.43
▸ KMT2A Q03164 2/20 0.40
▸ CTSK P43235 1/20 0.35
▸ MDM4 O15151 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ FABP7 O15540 2/20 0.34
▸ FABP5 Q01469 2/20 0.34
▸ CASP3 P42574 2/20 0.34

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
SCHEMBL3487402 0.81 EPHX2 (0.45) EPHX2KMT2ACTSKMDM4TP53
SCHEMBL1967548 0.74 EPHX2 (0.46) EPHX2KMT2ACTSKMDM4TP53
SCHEMBL1967550 0.73 GDA (0.52) EPHX2KMT2A
SCHEMBL14062476 0.71 KMT2A (0.43) EPHX2KMT2A
SCHEMBL14338159 0.70 EPHX2 (0.50) EPHX2KMT2ACTSKMDM4TP53
SCHEMBL3485982 0.68 EPHX2 (0.43) EPHX2KMT2ACTSKMDM4TP53
SCHEMBL8366872 0.66 EPHX2 (0.75) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL30563238 0.66 KMT2A (0.44) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL4254975 0.66 EPHX2 (0.53) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL5188515 0.66 EPHX2 (0.53) EPHX2KMT2AMDM4TP53FABP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097433-A2 OLIGONUCLEOTIDE ARRAYS Katholieke Universiteit Leuven (BE) 2009-09-09 — — EP claimed
WO-2008037036-A2 OLIGONUCLEOTIDE ARRAYS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2008-04-03 — — WO claimed
US-20100009865-A1 OLIGONUCLEOTIDE ARRAYS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2010-01-14 — — US disclosed
EP-2097433-A2 OLIGONUCLEOTIDE ARRAYS Katholieke Universiteit Leuven (BE) 2009-09-09 — — EP disclosed
WO-2008037036-A2 OLIGONUCLEOTIDE ARRAYS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2008-04-03 — — WO disclosed
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