SCHEMBL3091706

SCHEMBL3091706

NC(=O)CCC(O)(C(N)=O)N(CP(=O)(O)O)CP(=O)(O)O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
ADRB3 P13945 1/20 0.31
FDPS P14324 1/20 0.31
PDE4D Q08499 1/20 0.31
PDE3A Q14432 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
SCHEMBL3091716 0.88 FOLH1 (0.32) LMNA
SCHEMBL3108202 0.81 FDPS (0.44) LMNAADRB3FDPSPDE4DPDE3A
SCHEMBL3108182 0.81 FDPS (0.44) LMNAADRB3FDPSPDE4DPDE3A
SCHEMBL3105976 0.79 FDPS (0.46) LMNAADRB3FDPSPDE4DPDE3A
SCHEMBL3105994 0.79 FDPS (0.46) LMNAADRB3FDPSPDE4DPDE3A
SCHEMBL3103122 0.76 CA12 (0.31)
SCHEMBL3103107 0.76 CA12 (0.31)
SCHEMBL3103571 0.73 ALOX15 (0.32)
SCHEMBL2990340 0.73 FOLH1 (0.33) LMNA
SCHEMBL3103653 0.72 ALOX15 (0.34)

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