SCHEMBL9819252

SCHEMBL9819252

CCc1cc(NC(P(=O)(O)O)P(=O)(O)O)no1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 12/20 0.47
FDFT1 P37268 2/20 0.43
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
MMP8 P22894 1/20 0.38

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
SCHEMBL9819343 0.88 RAB9A (0.49) FDPSFDFT1MAPT
SCHEMBL9819288 0.85 FDPS (0.51) FDPSFDFT1
SCHEMBL9819305 0.84 FDPS (0.47) FDPSFDFT1
SCHEMBL9819397 0.83 PPARA (0.47) FDPSFDFT1
SCHEMBL9819447 0.83 PPARA (0.47) FDPSFDFT1
SCHEMBL9819301 0.82 FDPS (0.41) FDPSFDFT1
SCHEMBL9790653 0.78 TRPM8 (0.56) FDPSFDFT1MAPTCA12CA1
SCHEMBL11401437 0.77 FDPS (0.47) FDPSFDFT1
SCHEMBL9819303 0.75 FDPS (0.51) FDPSMAPTCA12CA1MMP8
SCHEMBL9819210 0.70 NPC1 (0.46) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0282320-B1 BISPHOSPHONIC ACID DERIVATIVES AND MEDICINES CONTAINING THE SAME YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-12-11 EP disclosed
US-4973576-A ANTIARTHRITIC AGENTS, TREATMENT OF HYPERCALCEMIA YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-11-27 US disclosed
EP-0282320-A1 Bisphosphonic acid derivatives and medicines containing the same YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-09-14 EP disclosed