SCHEMBL8928291

SCHEMBL8928291

O=P(O)(O)C(CO)N1CCN(C(CO)P(=O)(O)O)CCN(C(CO)P(=O)(O)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.39
MAPT P10636 2/20 0.34
ATM Q13315 1/20 0.34
ANPEP P15144 2/20 0.33
ERAP2 Q6P179 1/20 0.33
KDM4E B2RXH2 1/20 0.30
MMP2 P08253 1/20 0.30
THRB P10828 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL7816405 0.73 ALDH1A1 (0.45) FDPSTHRBHSD17B10
SCHEMBL3225195 0.73 FDPS (0.48) FDPSMAPTANPEPERAP2MMP2
Ammonia Solution, Strong SCHEMBL786750 0.72 ALDH1A1 (0.44) FDPSTHRBHSD17B10
SCHEMBL4410158 0.70 FDPS (0.50) FDPSMAPTANPEPERAP2MMP2
SCHEMBL18149022 0.70 FDPS (0.35) FDPSMAPTATMANPEPERAP2
SCHEMBL8928325 0.68 LAP3 (0.53) ANPEPERAP2
SCHEMBL4407985 0.67 FDPS (0.47) FDPSANPEPERAP2
SCHEMBL4736414 0.67 ANPEP (0.38) FDPSANPEPERAP2
SCHEMBL898693 0.67 FDPS (0.75) FDPSANPEPERAP2KDM4EMMP2
SCHEMBL203348 0.67 FDPS (0.75) FDPSANPEPERAP2KDM4EMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5593659-A IN THE FORM OF PHYSIOLOGICALLY ACCEPTABLE SALTS; MEDICAL DIAGNOSIS; WATER SOLUBLE, NONTOXIC CONCAT, LTD. (US) 1997-01-14 US disclosed
EP-0513000-B1 MRI IMAGE ENHANCEMENT OF BONE AND RELATED TISSUE USING COMPLEXES OF PARAMAGNETIC CATIONS AND POLYPHOSPHONATE LIGANDS CONCAT LTD (US) 1996-07-31 EP disclosed
US-5380515-A CONTRAST CONCAT, LTD. (US) 1995-01-10 US disclosed
US-5236695-A Medical diagnosis CONCAT, LTD. (US) 1993-08-17 US disclosed
EP-0513000-A1 MRI IMAGE ENHANCEMENT OF BONE AND RELATED TISSUE USING COMPLEXES OF PARAMAGNETIC CATIONS AND POLYPHOSPHONATE LIGANDS. CONCAT LTD (US) 1992-11-19 EP disclosed
EP-0513000-A4 MRI IMAGE ENHANCEMENT OF BONE AND RELATED TISSUE USING COMPLEXES OF PARAMAGNETIC CATIONS AND POLYPHOSPHONATE LIGANDS. CONCAT LTD (US) 1992-09-01 EP disclosed
WO-1991007911-A1 MRI IMAGE ENHANCEMENT OF BONE AND RELATED TISSUE USING COMPLEXES OF PARAMAGNETIC CATIONS AND POLYPHOSPHONATE LIGANDS CONCAT LTD. (US) 1991-06-13 WO disclosed