SCHEMBL6220901

SCHEMBL6220901

CCc1cnc(C(P(=O)(O)O)P(=O)(O)O)s1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.56
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
CDK5 Q00535 1/20 0.35
SMYD3 Q9H7B4 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
FBP1 P09467 2/20 0.32
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SRC P12931 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
SCHEMBL6220575 0.84 FDPS (0.60) FDPSCCNE1CDK2CDK5FBP1
SCHEMBL6221260 0.77 FDPS (0.53) FDPSSMN1; SMN2
SCHEMBL2753989 0.74 FDPS (0.41) FDPSCCNE1CDK2CDK5SMYD3
SCHEMBL7945367 0.72 FDPS (1.00) FDPSCCNE1CDK2CDK5
SCHEMBL19504522 0.72 FDPS (0.40) FDPSCCNE1CDK2CDK5SMYD3
SCHEMBL155863 0.66
SCHEMBL6220904 0.66 PTPRB (0.36) FDPS
SCHEMBL17065253 0.64 SMYD3 (0.44) FDPSCCNE1CDK2CDK5SMYD3
SCHEMBL1398205 0.62
SCHEMBL3072164 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854724-B1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 2005-03-16 EP claimed
US-6057306-A ADMINISTERING BISPHOSPHONATES TO TREAT BONE DISEASE NOVARTIS CORPORATION (US) 2000-05-02 US claimed
EP-0854724-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES Novartis AG (CH) 1998-07-29 EP claimed
WO-1997012619-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 1997-04-10 WO claimed
EP-0854724-B1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 2005-03-16 EP disclosed
US-6057306-A ADMINISTERING BISPHOSPHONATES TO TREAT BONE DISEASE NOVARTIS CORPORATION (US) 2000-05-02 US disclosed
EP-0854724-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES Novartis AG (CH) 1998-07-29 EP disclosed
WO-1997012619-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 1997-04-10 WO disclosed