SCHEMBL7863109

SCHEMBL7863109

CCOC(=O)C(O)(CCN(C)C)P(=O)(OCC)OCC

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP4F2 P78329 2/20 0.32
CYP4A11 Q02928 2/20 0.32
THRB P10828 1/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30
MAPT P10636 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRM3 P20309 1/20 0.30
CHRNA4 P43681 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
SCHEMBL7860042 0.86 ANPEP (0.33) MEN1KMT2ATHRBPKMHTT
SCHEMBL7862996 0.86 ALDH1A1 (0.30) MEN1KMT2AALDH1A1
SCHEMBL10468127 0.80 MAPT (0.37) MEN1KMT2ACYP4F2CYP4A11THRB
SCHEMBL7859916 0.77 MEN1 (0.57) MEN1KMT2ACYP4F2CYP4A11THRB
SCHEMBL8049781 0.76 FDPS (0.39) ALDH1A1TSHR
SCHEMBL7853836 0.74 ALDH1A1 (0.37) KMT2AHTTALDH1A1TSHR
SCHEMBL4903214 0.73 MAPK1 (0.32) MEN1KMT2APKMMAPT
SCHEMBL4906424 0.72 ALDH1A1 (0.35) ALDH1A1TSHRMAPT
SCHEMBL10299298 0.71 MMP8 (0.43) MEN1KMT2ACYP4F2CYP4A11THRB
SCHEMBL11749488 0.70 MAPT (0.32) CYP4F2CYP4A11MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788362-B1 PHOSPONOCARBOXYLATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMA (US) 2001-07-25 EP disclosed
US-5760021-A TREATING OR PREVENTING METABOLIC BONE DISORDERS THE PROCTER & GAMBLE COMPANY (US) 1998-06-02 US disclosed
EP-0788362-A1 PHOSPONOCARBOXYLATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1997-08-13 EP disclosed
WO-1993024131-A1 PHOSPONOCARBOXYLATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1993-12-09 WO disclosed