SCHEMBL4520271

SCHEMBL4520271

COC(=O)/C=C/[C@H]1CC[C@@H](c2cccc(Cl)c2)N1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.45
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RIPK1 Q13546 2/20 0.40
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
PDE5A O76074 1/20 0.36
MAPT P10636 1/20 0.36
ADAM17 P78536 1/20 0.35
GRM5 P41594 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
SLC6A3 Q01959 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
SCHEMBL4520273 1.00 FFAR2 (0.45) FFAR2KDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL4514259 0.87 RIPK1 (0.41) FFAR2ALDH1A1RIPK1MAOAMAOB
SCHEMBL4514257 0.87 RIPK1 (0.41) FFAR2ALDH1A1RIPK1MAOAMAOB
SCHEMBL2587020 0.86 RIPK1 (0.41) FFAR2KDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL4056330 0.86 FFAR2 (0.41) FFAR2KDM4EALDH1A1RIPK1SLC6A3
SCHEMBL4056327 0.86 FFAR2 (0.41) FFAR2KDM4EALDH1A1RIPK1SLC6A3
SCHEMBL2588030 0.86 FFAR2 (0.39) FFAR2KDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL4501814 0.83 FFAR2 (0.44) FFAR2
SCHEMBL4087604 0.83 FFAR2 (0.44) FFAR2
SCHEMBL4087600 0.83 FFAR2 (0.44) FFAR2

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 FFAR2 3021/4885KDM4E 3761/4885ALDH1A1 869/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 FFAR2 3021/4885KDM4E 3761/4885ALDH1A1 869/4885

“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.