SCHEMBL1399134

SCHEMBL1399134

Cc1ccc(CN2CCCN(C(=O)/C=C/C=C/c3ccccc3C#N)CC2)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.55
APP P05067 2/20 0.42
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.38
MTOR P42345 1/20 0.38
RPTOR Q8N122 1/20 0.38
MLST8 Q9BVC4 1/20 0.38

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
SCHEMBL1399086 1.00 GRIN2B (0.55) GRIN2BAPPMAPTALDH1A1GAA
SCHEMBL1399138 0.91 APP (0.44) GRIN2BAPPMAPTALDH1A1GAA
SCHEMBL1399136 0.91 APP (0.44) GRIN2BAPPMAPTALDH1A1GAA
SCHEMBL1399059 0.77 MAPT (0.58) GRIN2BAPPMAPTALDH1A1GAA
SCHEMBL1399058 0.77 MAPT (0.58) GRIN2BAPPMAPTALDH1A1GAA
SCHEMBL1399049 0.73 F2R (0.39) APPMAPT
SCHEMBL1399051 0.73 F2R (0.39) APPMAPT
SCHEMBL1399035 0.71 F2R (0.44) MAPTALDH1A1
SCHEMBL1399105 0.71 GAA (0.47) MAPTALDH1A1GAA
SCHEMBL1399107 0.71 GAA (0.47) MAPTALDH1A1GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046748-B1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PF MEDICAMENT (FR) 2011-03-02 EP claimed
US-20100003260-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PIERRE FABRE MEDICAMENT (FR) 2010-01-07 US claimed
EP-2046748-B1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PF MEDICAMENT (FR) 2011-03-02 EP 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 (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-20100003260-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS F2R, F2RL1, FPR1 GRIN2B 2264/4885APP 1442/4885MAPT 3903/4885

“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.