SCHEMBL4650967

SCHEMBL4650967

COc1ccc(CCCCNC(=O)[C@H](Cc2ccc(OC(F)C(=O)O)c(N)c2)NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 8/20 0.44
ITGAV P06756 8/20 0.44
ITGA2B P08514 8/20 0.44
BMP1 P13497 3/20 0.43
MMP2 P08253 2/20 0.43
MMP9 P14780 2/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.41
MMP3 P08254 1/20 0.41
AVPR1B P47901 1/20 0.41
NPY5R Q15761 1/20 0.41

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
SCHEMBL4650233 0.94 ITGB3 (0.48) ITGB3ITGAVITGA2BAVPR1BNPY5R
SCHEMBL4650241 0.93 ITGB3 (0.45) ITGB3ITGAVITGA2BBMP1POLB
SCHEMBL4651098 0.90 HSD17B10 (0.45) ITGB3ITGAVITGA2BHSD17B10AVPR1B
SCHEMBL4650264 0.90 NPY5R (0.52) ITGB3ITGAVITGA2BMMP9AVPR1B
SCHEMBL4650222 0.89 ITGB3 (0.53) ITGB3ITGAVITGA2B
SCHEMBL7114722 0.89 ITGB3 (0.53) ITGB3ITGAVITGA2B
SCHEMBL4650447 0.86 ITGB3 (0.50) ITGB3ITGAVITGA2B
SCHEMBL4651088 0.86 MAPT (0.43) ITGB3ITGAVITGA2BAVPR1B
SCHEMBL4650994 0.86 ITGB3 (0.57) ITGB3ITGAVITGA2BNPY5R
SCHEMBL14066274 0.86 MAPT (0.49) ITGB3ITGAVITGA2BAVPR1BNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301474-B1 TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC (US) 2008-09-10 EP claimed
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 ITGB3 3242/4885ITGAV 4271/4885ITGA2B 2530/4885

“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.