SCHEMBL10864153

SCHEMBL10864153

CCC(NC)C(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 14/20 0.41
GGPS1 O95749 6/20 0.33
MMP1 P03956 2/20 0.33
MMP2 P08253 2/20 0.33
LMNA P02545 2/20 0.33
LAP3 P28838 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP8 P22894 1/20 0.33
CA9 Q16790 1/20 0.33
MMP3 P08254 1/20 0.32
ADRB3 P13945 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE3A Q14432 1/20 0.32
ANPEP P15144 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
SCHEMBL8048681 0.71 FDPS (0.40) FDPSGGPS1
SCHEMBL8607151 0.71
SCHEMBL18492843 0.69
SCHEMBL5489929 0.68 LAP3 (0.46) FDPSGGPS1LMNALAP3ADRB3
SCHEMBL6132043 0.68 LAP3 (0.46) FDPSGGPS1LMNALAP3ADRB3
SCHEMBL11779062 0.64 FDPS (0.40) FDPSGGPS1LMNALAP3
SCHEMBL7511455 0.63 LMNA (0.45) FDPSGGPS1LMNALAP3CA2
SCHEMBL13669535 0.63
SCHEMBL16819057 0.62
SCHEMBL8052588 0.62 FDPS (0.52) FDPSGGPS1

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
EP-0175315-A2 4-Dimethylamino-1-hydroxybutane-1,1-diphosphonic acid, its water soluble salts, process for their preparation and its use Henkel Kommanditgesellschaft auf Aktien (DE) 1986-03-26 EP disclosed