SCHEMBL10705677

SCHEMBL10705677

O=P(O)(O)C(O)(CCc1cscn1)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 19/20 0.43
PDE3A Q14432 2/20 0.37
LMNA P02545 1/20 0.37
ADRB3 P13945 1/20 0.37
PDE4D Q08499 1/20 0.37
SLC6A3 Q01959 1/20 0.35
GGPS1 O95749 1/20 0.34

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
SCHEMBL4295158 0.82 SLC6A3 (0.35) LMNASLC6A3
SCHEMBL10624853 0.71 GABRA5 (0.46) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL10624905 0.71 SMN1; SMN2 (0.45) FDPSSLC6A3GGPS1
SCHEMBL13412470 0.71 ALDH1A1 (0.38) LMNASLC6A3
SCHEMBL16716829 0.71 PGK1 (0.45) SLC6A3
SCHEMBL10622087 0.70 FDPS (0.71) FDPSLMNA
SCHEMBL7157650 0.70 FDPS (0.50) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL10709303 0.67 FDPS (0.50) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL10624770 0.67 FDPS (0.46) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL10706646 0.67 FDPS (0.50) FDPSPDE3ALMNAADRB3PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0170228-B1 DIPHOSPHONIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM Roche Diagnostics GmbH (DE) 1988-12-28 EP disclosed
US-4687767-A Certain 1-hydroxyethane, 1,1-di-phosphonic acid derivatives useful in treating calcium metabolism disturbances BOEHRINGER MANNHEIM GMBH (DE) 1987-08-18 US disclosed
EP-0170228-A1 Diphosphonic-acid derivatives, process for their preparation and medicines containing them Roche Diagnostics GmbH (DE) 1986-02-05 EP disclosed