SCHEMBL2985126

SCHEMBL2985126

NCCCCC(NCCP(=O)(O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.46
GGT1 P19440 1/20 0.45
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
NFKB1 P19838 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
GSR P00390 1/20 0.42
RNPEP Q9H4A4 1/20 0.41
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
CPB2 Q96IY4 2/20 0.38
SLC6A5 Q9Y345 1/20 0.37
TLR2 O60603 1/20 0.37
ALDH1A1 P00352 1/20 0.36
ECE1 P42892 1/20 0.36
BHMT Q93088 1/20 0.36
OTC P00480 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL27764518 0.95 GGT1 (0.46) FOLH1GGT1LMNACYP3A4NFKB1
SCHEMBL2991537 0.95 GGT1 (0.46) FOLH1GGT1LMNACYP3A4NFKB1
SCHEMBL3095512 0.87 LMNA (0.42) FOLH1LMNACYP3A4NFKB1BLM
SCHEMBL2987580 0.83 FOLH1 (0.49) FOLH1GGT1LMNACYP3A4NFKB1
SCHEMBL2987576 0.83 FOLH1 (0.49) FOLH1GGT1LMNACYP3A4NFKB1
SCHEMBL148480 0.83 FOLH1 (0.54) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL610133 0.83 GGT1 (0.62) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL7076576 0.83 FOLH1 (0.54) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL6316197 0.83 FOLH1 (0.54) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL610134 0.83 GGT1 (0.62) FOLH1GGT1GSRRNPEPMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776844-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2010-08-17 US claimed
US-20090208499-A1 N-(Phosphonoalkyl)-Amino Acids, Derivatives Thereof and Compositions and Methods of Use YU RUEY J 2009-08-20 US claimed
US-7572776-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2009-08-11 US claimed
JP-2009526755-A 2009-07-23 JP claimed
US-20080306025-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2008-12-11 US claimed
EP-1979366-A2 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE Yu, Ruey J. (US) 2008-10-15 EP claimed
WO-2007082206-A2 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J (US) 2007-07-19 WO claimed
US-20070161543-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2007-07-12 US claimed
US-20100247463-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2010-09-30 US disclosed
US-7776844-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2010-08-17 US disclosed
US-20090208499-A1 N-(Phosphonoalkyl)-Amino Acids, Derivatives Thereof and Compositions and Methods of Use YU RUEY J 2009-08-20 US disclosed
US-7572776-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2009-08-11 US disclosed
US-20080306025-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2008-12-11 US disclosed
US-7429575-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2008-09-30 US disclosed
US-20070161543-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2007-07-12 US disclosed