SCHEMBL9790803

SCHEMBL9790803

O=P(O)(O)C(Nc1ncc(Cl)s1)P(=O)(O)O

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 13/20 0.66
FDFT1 P37268 2/20 0.49
ALOX15 P16050 1/20 0.42
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
CA14 Q9ULX7 1/20 0.40
FFAR2 O15552 1/20 0.40

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
SCHEMBL7164309 0.79 FDPS (1.00) FDPSMMP8
SCHEMBL9790756 0.78 FDPS (0.97) FDPSMMP8
SCHEMBL9790652 0.77 FDPS (1.00) FDPSFDFT1
SCHEMBL7945367 0.76 FDPS (1.00) FDPSFDFT1MMP8
SCHEMBL9790811 0.74 FDPS (0.61) FDPSMMP8MMP14CA14
SCHEMBL9790749 0.73 FDPS (1.00) FDPSFDFT1MMP8
SCHEMBL9790770 0.73 FDPS (0.60) FDPSMMP8MMP14CA14
SCHEMBL12411192 0.72 MAPK14 (0.46) FDPSALOX15FFAR2
SCHEMBL7163557 0.71 FDPS (1.00) FDPSFDFT1
SCHEMBL9790768 0.70 FDPS (0.80) FDPS

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-5057505-A Treatment of illnesses attributed to calcium metabolism disorders CIBA-GEIGY CORPORATION (US) 1991-10-15 US disclosed