SCHEMBL16173545

SCHEMBL16173545

COC(=O)[C@@H](Cc1ccc(OCCl)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.56
ITGA2B P08514 1/20 0.56
KLK5 Q9Y337 1/20 0.53
HDAC8 Q9BY41 1/20 0.52
PTPN1 P18031 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
BCL2 P10415 1/20 0.49
CTSS P25774 6/20 0.48
CTSK P43235 5/20 0.48
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
YAP1 P46937 1/20 0.47
ACE P12821 1/20 0.46
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45

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
SCHEMBL14365476 1.00 ITGB3 (0.56) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL14477358 0.94 ITGB3 (0.57) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL5892285 0.91 ITGB3 (0.60) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL2728593 0.91 ITGB3 (0.60) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL22604385 0.89 GAA (0.60) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL14343053 0.89 ITGB3 (0.70) ITGB3ITGA2BHDAC8PTPN1BCL2
SCHEMBL27584108 0.88 ITGB3 (0.56) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL16134507 0.88 ITGB3 (0.56) ITGB3ITGA2BKLK5HDAC8PTPN1
SCHEMBL5408845 0.87 PPARG (0.57) ITGB3ITGA2BKLK5HDAC8MEN1
SCHEMBL5408855 0.87 PPARG (0.57) ITGB3ITGA2BKLK5HDAC8MEN1

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
US-20140309424-A1 DIRECT SYNTHESIS OF 18F-FLUOROMETHOXY COMPOUNDS FOR PET IMAGING AND THE PROVISION OF NEW PRECURSORS FOR DIRECT RADIOSYNTHESIS OF PROTECTED DERIVATIVES OF O-([18F] FLUOROMETHYL) TYROSINE PIRAMAL IMAGING SA (CH) 2014-10-16 US disclosed
US-20140309424-A1 DIRECT SYNTHESIS OF 18F-FLUOROMETHOXY COMPOUNDS FOR PET IMAGING AND THE PROVISION OF NEW PRECURSORS FOR DIRECT RADIOSYNTHESIS OF PROTECTED DERIVATIVES OF O-([18F] FLUOROMETHYL) TYROSINE PIRAMAL IMAGING SA (CH) 2014-10-16 US 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-20140309424-A1 DIRECT SYNTHESIS OF 18F-FLUOROMETHOXY COMPOUNDS FOR PET IMAGING AND THE PROVISION OF NEW PRECURSORS FOR DIRECT RADIOSYNTHESIS OF PROTECTED DERIVATIVES OF O-([18F] FLUOROMETHYL) TYROSINE TH, TYR, FTO ITGB3 2717/4885ITGA2B 3431/4885KLK5 2358/4885

“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.