SCHEMBL889971

SCHEMBL889971

O=C(CCNC(=O)OCC1c2ccccc2-c2ccccc21)NCC(O)CO

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
TLR2 O60603 2/20 0.45
EPHX2 P34913 1/20 0.44

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
SCHEMBL888340 1.00 KMT2A (0.57) KMT2ATLR2EPHX2
SCHEMBL888338 1.00 KMT2A (0.57) KMT2ATLR2EPHX2
SCHEMBL12703680 0.89 KMT2A (0.55) KMT2AEPHX2
SCHEMBL12761610 0.84 KMT2A (0.59) KMT2AEPHX2
SCHEMBL3140809 0.82 KMT2A (0.73) KMT2ATLR2EPHX2
SCHEMBL13525077 0.82 KMT2A (0.73) KMT2ATLR2EPHX2
SCHEMBL889867 0.81 KMT2A (0.65) KMT2ATLR2EPHX2
SCHEMBL888350 0.81 KMT2A (0.65) KMT2ATLR2EPHX2
SCHEMBL888348 0.81 KMT2A (0.65) KMT2ATLR2EPHX2
SCHEMBL30861274 0.81 MDM4 (0.52) KMT2ATLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8465921-B2 Hybridization and mismatch discrimination using oligonucleotides conjugated to minor groove binders ELITECH HOLDING B.V. (NL) 2013-06-18 US disclosed
US-20110275070-A1 HYBRIDIZATION AND MISMATCH DISCRIMINATION USING OLIGONUCLEOTIDES CONJUGATED TO MINOR GROOVE BINDERS EPOCH PHARMACEUTICALS, INC. 2011-11-10 US disclosed
US-7556923-B1 Hybridization and mismatch discrimination using oligonucleotides conjugated to minor groove binders EPOCH BIOSCIENCES, INC. (US) 2009-07-07 US disclosed
US-6492346-B1 Hybridization and mismatch discrimination using oligonucleotides conjugated to minor groove binders EPOCH PHARMACEUTICALS, INC. 2002-12-10 US disclosed