SCHEMBL4651111

SCHEMBL4651111

O=C(O)COc1ccc(C(CC(=O)NCCC(c2ccccc2)c2ccccc2)NS(=O)(=O)c2ccccc2)cc1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
EEF2K O00418 3/20 0.40
LMNA P02545 1/20 0.40
ATM Q13315 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
BDKRB1 P46663 1/20 0.38
CNR1 P21554 2/20 0.38
CNR2 P34972 1/20 0.37
POLB P06746 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGAV P06756 1/20 0.36
PTPN1 P18031 1/20 0.36

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
SCHEMBL4650271 0.89 BDKRB1 (0.45) ALDH1A1LMNAATML3MBTL1BDKRB1
SCHEMBL4650884 0.88 PTPN1 (0.49) ALDH1A1LMNAATML3MBTL1PTPN1
SCHEMBL4651105 0.88 PTPN1 (0.44) ALDH1A1LMNAL3MBTL1BDKRB1PTPN1
SCHEMBL7054363 0.87 PTPN1 (0.46) ALDH1A1LMNAL3MBTL1BDKRB1PTPN1
SCHEMBL4651379 0.87 ALDH1A1 (0.58) ALDH1A1LMNAPOLBPTPN1
SCHEMBL4650872 0.84 ALDH1A1 (0.60) ALDH1A1POLBPTPN1
SCHEMBL7050019 0.83 ALDH1A1 (0.54) ALDH1A1POLBPTPN1
SCHEMBL4650322 0.82 ALDH1A1 (0.48) ALDH1A1L3MBTL1POLBKDM4E
SCHEMBL4651316 0.82 ALDH1A1 (0.48) ALDH1A1LMNABDKRB1POLBKDM4E
SCHEMBL4651106 0.79 PTPN1 (0.51) LMNAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6586467-B2 Tyrosine phosphatase inhibitors useful in the treatment or prevention of Type II Diabetes Mellitus ARRAY BIOPHARMA INC. 2003-07-01 US claimed
EP-1301474-A2 TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS Array Biopharma Inc. (US) 2003-04-16 EP claimed
US-20020040003-A1 Preparation of phosphatase inhibitors ARRAY BIOPHARMA INC. 2002-04-04 US claimed
WO-2002004412-A2 TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2002-01-17 WO claimed
EP-1301474-B1 TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC (US) 2008-09-10 EP disclosed
US-6586467-B2 Tyrosine phosphatase inhibitors useful in the treatment or prevention of Type II Diabetes Mellitus ARRAY BIOPHARMA INC. 2003-07-01 US disclosed
EP-1301474-A2 TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS Array Biopharma Inc. (US) 2003-04-16 EP disclosed
US-20020040003-A1 Preparation of phosphatase inhibitors ARRAY BIOPHARMA INC. 2002-04-04 US disclosed
WO-2002004412-A2 TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2002-01-17 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-20020040003-A1 Preparation of phosphatase inhibitors PTPRS, PTPRO, PTPRR ALDH1A1 446/4885EEF2K 2692/4885LMNA 4283/4885

“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.