SCHEMBL1399059

SCHEMBL1399059

Cc1ccccc1CN1CCCN(C(=O)C=CC=Cc2ccccc2Cl)CC1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
F2R P25116 1/20 0.53
APP P05067 2/20 0.50
ALDH1A1 P00352 4/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
KDM4E B2RXH2 2/20 0.45
GRIN2B Q13224 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
GAA P10253 1/20 0.42
FABP6 P51161 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL1399058 1.00 MAPT (0.58) MAPTL3MBTL1F2RAPPALDH1A1
SCHEMBL2904078 0.88 F2R (0.67) MAPTL3MBTL1F2RAPPALDH1A1
SCHEMBL1399111 0.88 F2R (0.59) MAPTL3MBTL1F2RAPPALDH1A1
SCHEMBL1399113 0.88 F2R (0.59) MAPTL3MBTL1F2RAPPALDH1A1
SCHEMBL1399136 0.85 APP (0.44) MAPTL3MBTL1APPALDH1A1KMT2A
SCHEMBL1399138 0.85 APP (0.44) MAPTL3MBTL1APPALDH1A1KMT2A
SCHEMBL2905726 0.79 F2R (0.72) MAPTL3MBTL1F2RAPPALDH1A1
SCHEMBL1399134 0.77 GRIN2B (0.55) MAPTAPPALDH1A1GRIN2BGAA
SCHEMBL1399086 0.77 GRIN2B (0.55) MAPTAPPALDH1A1GRIN2BGAA
SCHEMBL1399078 0.76 MAPT (0.56) MAPTL3MBTL1F2RAPPALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022064-B2 Phenylpentadienoyl derivatives and their use as PAR 1 antagonists PIERRE FABRE MEDICAMENT (FR) 2011-09-20 US claimed
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-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS Pierre Fabre Medicament (FR) 2009-04-15 EP claimed
WO-2007147822-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PIERRE FABRE MEDICAMENT (FR) 2007-12-27 WO 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 MAPT 3903/4885L3MBTL1 2246/4885F2R 1/4885

“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.