SCHEMBL7029155

SCHEMBL7029155

N[C@@H](CCP(=O)(O)O)P(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 7/20 0.58
ENPEP Q07075 1/20 0.56
ERAP2 Q6P179 2/20 0.55
LAP3 P28838 5/20 0.54
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
ERAP1 Q9NZ08 3/20 0.48
S1PR2 O95136 4/20 0.47
S1PR1 P21453 4/20 0.47
S1PR3 Q99500 4/20 0.47
S1PR4 O95977 3/20 0.47

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
SCHEMBL57183 1.00 ANPEP (0.58) ANPEPENPEPERAP2LAP3ALDH1A1
SCHEMBL5163799 0.97 ANPEP (0.56) ANPEPENPEPERAP2LAP3ALDH1A1
Ammonia Solution, Strong SCHEMBL15328272 0.97 ANPEP (0.56) ANPEPENPEPERAP2LAP3ALDH1A1
Hypophosphorous Acid SCHEMBL7760738 0.91 ANPEP (0.50) ANPEPENPEPERAP2LAP3ALDH1A1
SCHEMBL718888 0.87 ANPEP (0.47) ANPEPENPEPERAP2LAP3ALDH1A1
Ethylenediamine SCHEMBL8018034 0.85 LMNA (0.52) ANPEPENPEPERAP2LAP3ALDH1A1
SCHEMBL1818974 0.84 ALDH1A1 (0.64) ANPEPENPEPERAP2LAP3ALDH1A1
SCHEMBL3947666 0.82 LAP3 (0.65) ANPEPENPEPERAP2LAP3ALDH1A1
Ammonia Solution, Strong SCHEMBL6544632 0.82 ALDH1A1 (0.61) ANPEPENPEPERAP2LAP3ALDH1A1
SCHEMBL10049945 0.82 LAP3 (0.54) ANPEPERAP2LAP3ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030013684-A1 Agricultural composition MITSUI CHEMICALS, INC. (JP) 2003-01-16 US disclosed
EP-1258191-A1 Agricultural composition Mitsui Chemicals, Inc. (JP) 2002-11-20 EP disclosed