SCHEMBL1917321

SCHEMBL1917321

CN1CC(c2ccc(-c3ccccc3-c3csc(N(C(=O)C(CC(=O)O)CC4CCCC4)C4CC4)n3)cn2)CN(C)C1=O

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 11/20 0.72
SLC12A5 Q9H2X9 4/20 0.34
CTSK P43235 1/20 0.32
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 1/20 0.31
TGFBR1 P36897 1/20 0.31
UCHL1 P09936 1/20 0.31
CYP1A2 P05177 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL1917312 1.00 FFAR2 (0.72) FFAR2SLC12A5CTSKMMP2MMP9
SCHEMBL1916443 0.93 FFAR2 (0.70) FFAR2SLC12A5MMP2MMP9MMP12
SCHEMBL1916310 0.92 FFAR2 (0.69) FFAR2SLC12A5MMP2MMP9MMP12
SCHEMBL2050968 0.92 FFAR2 (0.69) FFAR2SLC12A5
SCHEMBL1916033 0.92 FFAR2 (0.70) FFAR2SLC12A5CTSKMMP2MMP9
SCHEMBL1916677 0.90 FFAR2 (0.69) FFAR2SLC12A5UCHL1
SCHEMBL2026523 0.89 FFAR2 (0.70) FFAR2SLC12A5MMP2MMP9MMP12
SCHEMBL2048409 0.88 FFAR2 (0.69) FFAR2SLC12A5UCHL1NPC1LMNA
SCHEMBL1915908 0.88 FFAR2 (0.71) FFAR2SLC12A5UCHL1
SCHEMBL1916197 0.88 FFAR2 (0.75) FFAR2SLC12A5MMP2MMP9MMP12

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 claimed
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 EP claimed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 WO claimed

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 FFAR2 295/4885SLC12A5 715/4885CTSK 1144/4885

“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.