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Sugi Predict / Compounds / SCHEMBL6667933

SCHEMBL6667933

SCHEMBL6667933

CCCOP(=O)(O)C(N1CCN(C(P(=O)(O)O)P(=O)(O)OCCC)CCN(C(P(=O)(O)O)P(=O)(O)OCCC)CCN(C(P(=O)(O)O)P(=O)(O)OCCC)CC1)P(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 5/20 0.42
▸ LPAR5 Q9H1C0 1/20 0.35
▸ LPAR3 Q9UBY5 5/20 0.32
▸ LPAR1 Q92633 4/20 0.32
▸ LPAR2 Q9HBW0 2/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL6668133 0.90 CYP3A4 (0.42) FDPSLPAR5LPAR3LPAR1LPAR2
SCHEMBL6670360 0.85 FDPS (0.45) FDPS
SCHEMBL5075884 0.85 FDPS (0.45) FDPS
SCHEMBL6668405 0.74 FDPS (0.41) FDPSMEN1KMT2A
SCHEMBL9301817 0.73 FDPS (0.38) FDPS
SCHEMBL9301258 0.73 FDPS (0.38) FDPS
SCHEMBL8339034 0.73 ANPEP (0.38) FDPSMEN1KMT2A
SCHEMBL9302643 0.73 FDPS (0.38) FDPS
SCHEMBL9302623 0.72 FDPS (0.37) FDPS
SCHEMBL9302275 0.72 FDPS (0.37) 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 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