SCHEMBL2398129

SCHEMBL2398129

O=C(O)CC(CC1CCOCC1)C(=O)N(c1nc(-c2cc(F)ccc2-c2ccc(N3CCCC3=O)nc2)cs1)C1CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 9/20 0.57
CNR2 P34972 1/20 0.33
ENPP2 Q13822 2/20 0.32
GCK P35557 1/20 0.31
CCNK O75909 1/20 0.31
CDK9 P50750 1/20 0.31
AR P10275 1/20 0.30
MTOR P42345 1/20 0.30
RIPK3 Q9Y572 1/20 0.30

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
SCHEMBL1917365 1.00 FFAR2 (0.57) FFAR2CNR2ENPP2GCKCCNK
SCHEMBL2398865 0.98 FFAR2 (0.57) FFAR2CNR2ENPP2GCKCCNK
SCHEMBL1915844 0.98 FFAR2 (0.57) FFAR2CNR2ENPP2GCKCCNK
SCHEMBL1916322 0.95 FFAR2 (0.64) FFAR2CNR2
SCHEMBL1916319 0.95 FFAR2 (0.64) FFAR2CNR2
SCHEMBL1917826 0.93 FFAR2 (0.57) FFAR2CNR2
SCHEMBL2400130 0.93 FFAR2 (0.57) FFAR2CNR2
SCHEMBL1916164 0.93 FFAR2 (0.63) FFAR2CNR2
SCHEMBL1916167 0.93 FFAR2 (0.63) FFAR2CNR2
SCHEMBL2397473 0.92 FFAR2 (0.67) FFAR2CNR2GCK

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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US 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 295/4885CNR2 822/4885ENPP2 534/4885

“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.