SCHEMBL16173552

SCHEMBL16173552

CC(C)(C)OC(=O)[C@H](N)Cc1ccc(OC[19F])cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.46
PTPN1 P18031 1/20 0.44
ITGB3 P05106 3/20 0.43
ITGA2B P08514 3/20 0.43
ACACB O00763 9/20 0.41
SLC7A5 Q01650 1/20 0.40
NPR3 P17342 1/20 0.39
LAP3 P28838 1/20 0.38
GRB2 P62993 1/20 0.38

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
SCHEMBL14405380 1.00 LTA4H (0.46) LTA4HPTPN1ITGB3ITGA2BACACB
SCHEMBL1541948 0.86 ITGB3 (0.59) LTA4HPTPN1ITGB3ITGA2B
SCHEMBL16940459 0.85 ITGB3 (0.51) LTA4HITGB3ITGA2BACACB
SCHEMBL16355748 0.85 PTPN1 (0.48) LTA4HPTPN1ITGB3ITGA2BACACB
SCHEMBL2311154 0.84 ACACB (0.50) LTA4HPTPN1ITGB3ITGA2BACACB
SCHEMBL106531 0.84 LDHA (0.53) LTA4HPTPN1ACACBSLC7A5
SCHEMBL7518497 0.84 LDHA (0.53) LTA4HPTPN1ACACBSLC7A5
SCHEMBL16080173 0.84 ACACB (0.50) LTA4HPTPN1ITGB3ITGA2BACACB
SCHEMBL3729750 0.84 ACACB (0.50) LTA4HPTPN1ITGB3ITGA2BACACB
SCHEMBL2311151 0.84 ACACB (0.50) LTA4HPTPN1ITGB3ITGA2BACACB

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 1 patent. 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

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 LTA4H 3517/4885PTPN1 707/4885ITGB3 2717/4885

“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.