SCHEMBL8669544

SCHEMBL8669544

COC(=O)C(C)(C(C)(C)C(=O)O)P(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
DGAT1 O75907 1/20 0.34
LMNA P02545 1/20 0.32
KCNN4 O15554 1/20 0.31
FDPS P14324 1/20 0.31

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
SCHEMBL6596942 0.80 DGAT1 (0.38) PTPN1DGAT1LMNAKCNN4FDPS
SCHEMBL5707267 0.72 ALDH1A1 (0.31)
SCHEMBL1425286 0.72 DGAT1 (0.42) DGAT1KCNN4
SCHEMBL992 0.70 DGAT1 (0.41) PTPN1DGAT1LMNAKCNN4FDPS
SCHEMBL9697626 0.69 DGAT1 (0.39) PTPN1DGAT1LMNAKCNN4FDPS
Phosphoric Acid SCHEMBL28716950 0.67 DGAT1 (0.42) PTPN1DGAT1LMNAKCNN4FDPS
SCHEMBL2983925 0.67 LMNA (0.41) LMNAFDPS
Phosphoric Acid SCHEMBL29828181 0.67 DGAT1 (0.42) PTPN1DGAT1LMNAKCNN4FDPS
SCHEMBL11689517 0.67 HMGCR (0.39) PTPN1DGAT1LMNAKCNN4FDPS
SCHEMBL11777123 0.66 PTPN1 (0.35) PTPN1DGAT1LMNAFDPS

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-0569731-B1 Water treatment agent ALBRIGHT & WILSON UK LTD (GB) 1998-12-09 EP disclosed
EP-0569731-A2 Water treatment agent ALBRIGHT & WILSON UK LIMITED (GB) 1993-11-18 EP disclosed