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Sugi Predict / Compounds / SCHEMBL6670360

SCHEMBL6670360

SCHEMBL6670360

CCOP(=O)(O)C(N1CCN(C(P(=O)(O)O)P(=O)(O)OCC)CCN(C(P(=O)(O)O)P(=O)(O)OCC)CCN(C(P(=O)(O)O)P(=O)(O)OCC)CC1)P(=O)(O)O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 4/20 0.45
▸ TSHR P16473 2/20 0.39
▸ PPARD Q03181 2/20 0.35
▸ TP53 P04637 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ LAP3 P28838 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
SCHEMBL5075884 1.00 FDPS (0.45) FDPSTSHRPPARDTP53TDP1
SCHEMBL9301258 0.87 FDPS (0.38) FDPSTSHRPPARD
SCHEMBL9302643 0.87 FDPS (0.38) FDPSTSHRPPARD
SCHEMBL9301817 0.87 FDPS (0.38) FDPSTSHRPPARD
SCHEMBL9301070 0.85 FDPS (0.37) FDPSTSHR
SCHEMBL9302275 0.85 FDPS (0.37) FDPSTSHR
SCHEMBL9302623 0.85 FDPS (0.37) FDPSTSHR
SCHEMBL6667933 0.85 FDPS (0.42) FDPS
SCHEMBL9301453 0.84 FDPS (0.36) FDPSTSHR
SCHEMBL9300897 0.84 FDPS (0.36) FDPSTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882055-B1 POLYAZAMACROCYCLOFLUOROMONOALKYLPHOSPHONIC ACIDS, AND THEIR COMPLEXES, FOR USE AS CONTRAST AGENTS DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-22 — — EP disclosed
US-5834456-A MAGNETIC RESONANCE IMAGING AND IN VIVO SPECTROSCOPY OF FLUORINE; SENSITIVITY, TISSUE DISTRIBUTION THE DOW CHEMICAL COMPANY (US) 1998-11-10 — — US disclosed