SCHEMBL2400007

SCHEMBL2400007

O=C(O)CC(CC1CCCC1)C(=O)N(c1nc(-c2cc(C(F)(F)F)ccc2-c2ccc(N3CCCC3=O)nc2)cs1)C1CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 9/20 0.61
DGAT1 O75907 6/20 0.35
CNR2 P34972 1/20 0.33
KCNH2 Q12809 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ADORA2A P29274 1/20 0.32
USP19 O94966 1/20 0.32
SYK P43405 1/20 0.32
GCGR P47871 1/20 0.32
GIPR P48546 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 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
SCHEMBL1917175 1.00 FFAR2 (0.61) FFAR2DGAT1CNR2KCNH2CYP3A4
SCHEMBL1916322 0.93 FFAR2 (0.64) FFAR2CNR2USP19
SCHEMBL1916319 0.93 FFAR2 (0.64) FFAR2CNR2USP19
SCHEMBL1918381 0.91 FFAR2 (0.59) FFAR2CNR2USP19GCGRGIPR
SCHEMBL1918383 0.91 FFAR2 (0.59) FFAR2CNR2USP19GCGRGIPR
SCHEMBL1916167 0.91 FFAR2 (0.63) FFAR2CNR2USP19
SCHEMBL1916135 0.91 FFAR2 (0.63) FFAR2DGAT1CNR2KCNH2ADORA2A
SCHEMBL1916133 0.91 FFAR2 (0.63) FFAR2DGAT1CNR2KCNH2ADORA2A
SCHEMBL1916164 0.91 FFAR2 (0.63) FFAR2CNR2USP19
SCHEMBL1917149 0.90 FFAR2 (0.75) FFAR2CNR2USP19

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 295/4885DGAT1 197/4885CNR2 822/4885

“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.