Sugi Predict

Sugi Predict / Compounds / SCHEMBL2985627

SCHEMBL2985627

SCHEMBL2985627

NC(=O)NCCC[C@@H](C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OTC P00480 1/20 0.43
▸ C3AR1 Q16581 1/20 0.36
▸ FNTA P49354 1/20 0.33
▸ FNTB P49356 1/20 0.33
▸ SHMT1 P34896 1/20 0.33
▸ EPOR P19235 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.30
▸ DDAH1 O94760 1/20 0.30
▸ ITGB1 P05556 1/20 0.30
▸ ITGA5 P08648 1/20 0.30
▸ FOLH1 Q04609 1/20 0.30

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
SCHEMBL2985623 1.00 OTC (0.43) OTCC3AR1FNTAFNTBSHMT1
SCHEMBL2979471 0.95 OTC (0.39) OTCC3AR1FNTAFNTBSHMT1
SCHEMBL3091675 0.89 OTC (0.41) OTCC3AR1CA12CA1CA2
SCHEMBL3091671 0.89 OTC (0.41) OTCC3AR1CA12CA1CA2
SCHEMBL2990907 0.88 OTC (0.41) OTCFNTAFNTB
SCHEMBL2990914 0.88 OTC (0.41) OTCFNTAFNTB
SCHEMBL2992137 0.87 OTC (0.42) OTCC3AR1FNTAFNTBSHMT1
SCHEMBL27764620 0.87 OTC (0.42) OTCC3AR1FNTAFNTBSHMT1
SCHEMBL3103112 0.85 OTC (0.37) OTCFNTAFNTBEPORCA12
SCHEMBL2991241 0.84 OTC (0.38) OTCFNTAFNTBCA12CA1

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 14 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
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