SCHEMBL1917095

SCHEMBL1917095

Cn1c(=O)[nH]c2cc(-c3ccccc3-c3csc(N(C(=O)C(CC(=O)O)CC4CCCC4)C4CC4)n3)cnc21

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 11/20 0.69
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
P2RY12 Q9H244 2/20 0.35
SLC12A5 Q9H2X9 3/20 0.33
MTOR P42345 1/20 0.31
USP19 O94966 2/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 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
SCHEMBL1917089 1.00 FFAR2 (0.69) FFAR2PDE3BPDE3AP2RY12SLC12A5
SCHEMBL1917516 0.90 FFAR2 (0.68) FFAR2PDE3BPDE3AP2RY12
SCHEMBL1917511 0.90 FFAR2 (0.68) FFAR2PDE3BPDE3AP2RY12
SCHEMBL1916394 0.90 FFAR2 (0.70) FFAR2SLC12A5
SCHEMBL1916398 0.90 FFAR2 (0.70) FFAR2SLC12A5
SCHEMBL16498058 0.88 FFAR2 (0.68) FFAR2SLC12A5USP19MMP2MMP9
SCHEMBL16498057 0.88 FFAR2 (0.68) FFAR2SLC12A5USP19MMP2MMP9
SCHEMBL1915893 0.87 FFAR2 (0.71) FFAR2SLC12A5USP19MMP2MMP9
SCHEMBL2051654 0.87 FFAR2 (0.71) FFAR2SLC12A5MTORMMP2MMP9
SCHEMBL16498965 0.87 FFAR2 (0.71) 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 295/4885PDE3B 541/4885PDE3A 910/4885

“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.