SCHEMBL1915348

SCHEMBL1915348

CC(C)(C)OC(=O)CC(Cc1cccc(F)c1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.51
CTSK P43235 1/20 0.51
SLC1A1 P43005 2/20 0.48
SLC7A5 Q01650 1/20 0.46
FOLH1 Q04609 4/20 0.46
PPARG P37231 4/20 0.46
PPARA Q07869 3/20 0.45
CPA1 P15085 3/20 0.45
CPB1 P15086 1/20 0.43
CPA3 P15088 1/20 0.43
CPB2 Q96IY4 1/20 0.43
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
JAK2 O60674 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 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
SCHEMBL1915346 1.00 CTSS (0.51) CTSSCTSKSLC1A1SLC7A5FOLH1
SCHEMBL20734674 0.87 CPA1 (0.39) CTSSCTSKSLC7A5FOLH1CPA1
SCHEMBL30191465 0.85 SLC7A5 (0.44) CTSSCTSKSLC7A5FOLH1CPA1
SCHEMBL1915318 0.85 PPARA (0.49) SLC7A5FOLH1PPARGPPARACPA1
SCHEMBL1915315 0.85 PPARA (0.49) SLC7A5FOLH1PPARGPPARACPA1
SCHEMBL1915766 0.85 CPA1 (0.60) SLC1A1FOLH1CPA1CPB1CPA3
SCHEMBL1704171 0.85 CPA1 (0.60) SLC1A1FOLH1CPA1CPB1CPA3
SCHEMBL1704913 0.85 CPA1 (0.60) SLC1A1FOLH1CPA1CPB1CPA3
SCHEMBL1915659 0.85 CTSL (0.51) SLC7A5FOLH1PPARGPPARACPA1
SCHEMBL1915662 0.85 CTSL (0.51) SLC7A5FOLH1PPARGPPARACPA1

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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US disclosed
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 EP disclosed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC CTSS 1520/4885CTSK 1144/4885SLC1A1 1941/4885

“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.