SCHEMBL4511219

SCHEMBL4511219

C=CCC(=O)N1C(C=C)CCCC1c1ccccc1F

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
FFAR2 O15552 2/20 0.36
RIPK1 Q13546 9/20 0.36
SMN1; SMN2 Q16637 3/20 0.33
PDE5A O76074 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL4511222 1.00 PKM (0.39) PKMGAAKDM4EFFAR2RIPK1
SCHEMBL4521465 0.80 FFAR2 (0.38) FFAR2RIPK1SMN1; SMN2ALDH1A1
SCHEMBL4521461 0.80 FFAR2 (0.38) FFAR2RIPK1SMN1; SMN2ALDH1A1
SCHEMBL4520149 0.79 RIPK1 (0.45) PKMKDM4ERIPK1PDE5AALDH1A1
SCHEMBL4520150 0.79 RIPK1 (0.45) PKMKDM4ERIPK1PDE5AALDH1A1
SCHEMBL4097126 0.74 FFAR2 (0.43) FFAR2SMN1; SMN2ALDH1A1
SCHEMBL4514593 0.72 KDM4E (0.42) GAAKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4509143 0.72 FFAR2 (0.34) PKMFFAR2RIPK1
SCHEMBL4509140 0.72 FFAR2 (0.34) PKMFFAR2RIPK1
SCHEMBL4509815 0.72 FFAR2 (0.34) PKMFFAR2RIPK1

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 4 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-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 PKM 3737/4885GAA 1381/4885KDM4E 3761/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 PKM 3737/4885GAA 1381/4885KDM4E 3761/4885

“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.