SCHEMBL5560145

SCHEMBL5560145

CC(F)c1cc(O)cc(CC(N)C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 4/20 0.50
SIRT5 Q9NXA8 1/20 0.47
HSD17B10 Q99714 4/20 0.46
USP2 O75604 4/20 0.46
ADORA3 P0DMS8 3/20 0.46
ALOX15 P16050 3/20 0.46
PTGS1 P23219 2/20 0.46
PTGS2 P35354 2/20 0.46
KDM4E B2RXH2 2/20 0.46
RECQL P46063 2/20 0.46
HIF1A Q16665 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
EGFR P00533 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
HTR2A P28223 1/20 0.46
PKM P14618 2/20 0.45
ALPI P09923 1/20 0.45
XIAP P98170 1/20 0.45
GRIA2 P42262 1/20 0.44

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
SCHEMBL1483094 0.82 SLC7A5 (0.66) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL1483095 0.82 SLC7A5 (0.66) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL5566682 0.79 SLC7A5 (0.57) SLC7A5HSD17B10USP2ADORA3ALOX15
SCHEMBL6024170 0.78 SLC7A5 (0.61) SLC7A5HSD17B10USP2ADORA3ALOX15
SCHEMBL12803446 0.78 SLC7A5 (0.56) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL10064656 0.78 SLC7A5 (0.56) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL5560750 0.78 SLC7A5 (0.56) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL31524255 0.78 SLC7A5 (0.56) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL5560150 0.75 SLC7A5 (0.53) SLC7A5SIRT5HSD17B10USP2ADORA3
SCHEMBL16861128 0.74 SLC7A5 (0.50) SLC7A5SIRT5HSD17B10USP2ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189383-B2 Radioactively labelled amino acid analogues, their preparation and use MALLINCKRODT INC. 2007-03-13 US claimed
US-20060127306-A1 Radioactively labelled amino acid analogues, their preparation and use VRIJE UNIVERSITEIT BRUSSEL (BE) 2006-06-15 US claimed
US-20070081941-A1 F-18 Labeled Amino Acid Analogs MALLINCKRODT INC. (US) 2007-04-12 US disclosed
US-7189383-B2 Radioactively labelled amino acid analogues, their preparation and use MALLINCKRODT INC. 2007-03-13 US disclosed
US-20060127306-A1 Radioactively labelled amino acid analogues, their preparation and use VRIJE UNIVERSITEIT BRUSSEL (BE) 2006-06-15 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 (2 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-20070081941-A1 F-18 Labeled Amino Acid Analogs BCAT1, BCAT2, SLC1A5 SLC7A5 9/4885SIRT5 4156/4885HSD17B10 2197/4885
US-20060127306-A1 Radioactively labelled amino acid analogues, their preparation and use BCAT1, BCAT2, SLC1A5 SLC7A5 8/4885SIRT5 3652/4885HSD17B10 2307/4885

“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.