SCHEMBL18290276

SCHEMBL18290276

O=C(CCNC(=O)OCC1c2ccccc2-c2ccccc21)CNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.65
EPHX2 P34913 1/20 0.50
OPRD1 P41143 1/20 0.45
FABP7 O15540 2/20 0.43
FABP5 Q01469 2/20 0.43
CASP3 P42574 2/20 0.42

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
SCHEMBL31270657 0.88 KMT2A (0.71) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL28429395 0.88 KMT2A (0.71) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL31723463 0.88 KMT2A (0.67) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL15516456 0.88 KMT2A (0.67) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL12291373 0.87 KMT2A (0.62) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL29423575 0.86 KMT2A (0.81) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL29397906 0.86 KMT2A (0.81) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL178687 0.86 KMT2A (0.81) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL4557899 0.86 KMT2A (0.68) KMT2AEPHX2OPRD1FABP7FABP5
SCHEMBL3515002 0.86 KMT2A (0.68) KMT2AEPHX2OPRD1FABP7FABP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016196393-A2 AUTOPHAGY-INHIBITING COMPOUNDS AND USES THEREOF PRESAGE BIOSCIENCES, INC. (US) 2016-12-08 WO disclosed