SCHEMBL2587832

SCHEMBL2587832

COC(=O)CCCC[C@H]1CC[C@@H](c2ccc(F)c(F)c2)N1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.42
ALDH1A1 P00352 1/20 0.39
PTGER2 P43116 5/20 0.36
PTGER4 P35408 3/20 0.35
TBXA2R P21731 2/20 0.35
PTGER3 P43115 1/20 0.34
ATM Q13315 1/20 0.34
TRPA1 O75762 1/20 0.34
HCRTR2 O43614 1/20 0.34

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
SCHEMBL4512466 1.00 FFAR2 (0.42) FFAR2ALDH1A1PTGER2PTGER4TBXA2R
SCHEMBL2584676 0.92 FFAR2 (0.44) FFAR2ALDH1A1ATMTRPA1HCRTR2
SCHEMBL4501609 0.92 FFAR2 (0.44) FFAR2ALDH1A1ATMTRPA1HCRTR2
SCHEMBL2575503 0.88 PTGER2 (0.39) FFAR2ALDH1A1PTGER2PTGER4TBXA2R
SCHEMBL2584185 0.88 PTGER2 (0.39) FFAR2ALDH1A1PTGER2PTGER4TBXA2R
SCHEMBL2588094 0.80 FFAR2 (0.39) FFAR2ALDH1A1HCRTR2
SCHEMBL2585262 0.80 FFAR2 (0.39) FFAR2ALDH1A1HCRTR2
SCHEMBL4512679 0.79 FFAR2 (0.41) FFAR2ATMTRPA1HCRTR2
SCHEMBL4501421 0.79 FFAR2 (0.41) FFAR2ATMTRPA1HCRTR2
SCHEMBL4501426 0.79 FFAR2 (0.41) FFAR2ATMTRPA1HCRTR2

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
EP-1953158-B1 BICYCLIC CINNAMIDE COMPOUND EISAI R&D MAN CO LTD (JP) 2012-09-12 EP disclosed
US-8048878-B2 Two cyclic cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-11-01 US disclosed
US-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND KIMURA TEIJI 2009-07-16 US disclosed
EP-1953158-A1 BICYCLIC CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117839-A1 Two cyclic cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 US 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 (2 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-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND APP, BACE1, PSEN1 FFAR2 3021/4885ALDH1A1 869/4885PTGER2 1365/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 FFAR2 3021/4885ALDH1A1 869/4885PTGER2 1365/4885

“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.