SCHEMBL3087933

SCHEMBL3087933

CC(C)CCCCC([NH])P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.40
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39
LAP3 P28838 4/20 0.38
ANPEP P15144 3/20 0.37
ERAP1 Q9NZ08 1/20 0.37
METAP1 P53582 1/20 0.33
S1PR2 O95136 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33

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
SCHEMBL3084100 0.80 FDPS (0.63) FDPSLAP3S1PR2S1PR4S1PR1
SCHEMBL3076457 0.79 FDPS (0.60) FDPSLAP3S1PR2S1PR4S1PR1
SCHEMBL19761997 0.76 ALDH1A1 (0.58) FDPSALDH1A1TDP1LMNAS1PR2
SCHEMBL1100844 0.74 LPAR3 (0.56) FDPSALDH1A1TDP1LMNALAP3
SCHEMBL1100638 0.74 LPAR3 (0.56) FDPSALDH1A1TDP1LMNALAP3
SCHEMBL1100677 0.74 LPAR3 (0.56) FDPSALDH1A1TDP1LMNALAP3
SCHEMBL1100535 0.74 LPAR3 (0.56) FDPSALDH1A1TDP1LMNALAP3
SCHEMBL1101281 0.74 LPAR3 (0.56) FDPSALDH1A1TDP1LMNALAP3
SCHEMBL15510572 0.74 LPAR3 (0.56) FDPSALDH1A1TDP1LMNALAP3
SCHEMBL20058314 0.74 FDPS (0.68) FDPSLAP3

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 9 patents. 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 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
EP-1979366-A2 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE Yu, Ruey J. (US) 2008-10-15 EP disclosed
US-7429575-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2008-09-30 US disclosed
WO-2007082206-A2 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J (US) 2007-07-19 WO disclosed
US-20070161543-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2007-07-12 US disclosed