SCHEMBL3105964

SCHEMBL3105964

NC(=O)[C@H](CS)NCP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 2/20 0.35
MME P08473 3/20 0.33
ECE1 P42892 3/20 0.33
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
NFKB1 P19838 1/20 0.31
PTGS2 P35354 1/20 0.31
THPO P40225 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL3105955 1.00 ENPEP (0.35) ENPEPMMEECE1KDM4EMAPT
SCHEMBL3098199 0.85 ENPEP (0.33) ENPEPMMEECE1
SCHEMBL3098192 0.85 ENPEP (0.33) ENPEPMMEECE1
SCHEMBL3091754 0.82 MME (0.36) MMEECE1CA12CA1CA9
SCHEMBL3091760 0.82 MME (0.36) MMEECE1CA12CA1CA9
SCHEMBL2988686 0.82 KDM4E (0.45) ENPEPMMEECE1KDM4EMAPT
SCHEMBL2988687 0.82 KDM4E (0.45) ENPEPMMEECE1KDM4EMAPT
SCHEMBL4341296 0.80 LAP3 (0.40) MMEECE1CA12CA1CA9
SCHEMBL2976817 0.80 ECE1 (0.36) MMEECE1CA1MEN1KMT2A
SCHEMBL3105884 0.80 ECE1 (0.36) MMEECE1CA1MEN1KMT2A

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
US-20100247463-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2010-09-30 US claimed