SCHEMBL6001785

SCHEMBL6001785

CCN(CC)C(=O)c1cc(O)cc(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.59
RECQL P46063 1/20 0.59
HSP90AA1 P07900 5/20 0.55
HSP90AB1 P08238 5/20 0.55
HPGD P15428 6/20 0.52
TDP1 Q9NUW8 1/20 0.52
CYP1A2 P05177 1/20 0.50
BLM P54132 1/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPT P10636 2/20 0.48
CA12 O43570 3/20 0.48
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA7 P43166 3/20 0.48
CA9 Q16790 3/20 0.48
CA14 Q9ULX7 3/20 0.48
CA5A P35218 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL10013775 0.84 LMNA (0.53) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL1867393 0.80 HPGD (0.69) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL17264206 0.79 LMNA (0.61) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL11235339 0.79 LMNA (0.56) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL3741746 0.78 HPGD (0.67) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL1806308 0.78 HPGD (0.63) LMNAHSP90AA1HSP90AB1HPGDTDP1
SCHEMBL9065150 0.78 LMNA (0.59) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL9581244 0.77 LMNA (0.53) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL29175215 0.77 MLYCD (0.55) LMNARECQLHSP90AA1HSP90AB1HPGD
SCHEMBL11782473 0.77 HSP90AA1 (0.56) LMNARECQLHSP90AA1HSP90AB1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212296-B9 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN INC (US) 2006-05-10 EP disclosed
EP-1212296-B1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN INC (US) 2005-11-09 EP disclosed
US-20040138255-A1 Phosphate mimics and methods of treatment using phosphatease inhibitors SUGEN, INC. 2004-07-15 US disclosed
US-6596772-B1 Relates to trifluoromethyl sulfonyl and trifluoromethyl sulfonamido compounds and the physiologically acceptable salts and the prodrugs thereof. These compounds are expected to modulate the activity of protein tyrosine enzymes which are SUGEN, INC. 2003-07-22 US disclosed
EP-1212296-A1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS Sugen, Inc. (US) 2002-06-12 EP disclosed
WO-2001016097-A1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN, INC. (US) 2001-03-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040138255-A1 Phosphate mimics and methods of treatment using phosphatease inhibitors PPP4C, PTPRO, PTPRS LMNA 4848/4885RECQL 3965/4885HSP90AA1 3053/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.