SCHEMBL1399170

SCHEMBL1399170

O=C(C=CC=Cc1ccccc1Cl)N1CCN(C2CCCC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.61
MAPT P10636 1/20 0.61
F2R P25116 2/20 0.47
POLB P06746 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
LMNA P02545 1/20 0.45
HRH3 Q9Y5N1 6/20 0.45
KCNH2 Q12809 1/20 0.45
KDM4E B2RXH2 5/20 0.44
ALDH1A1 P00352 4/20 0.44
ATM Q13315 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
SCHEMBL1399169 1.00 L3MBTL1 (0.61) L3MBTL1MAPTF2RPOLBNPC1
SCHEMBL1399055 0.99 L3MBTL1 (0.60) L3MBTL1MAPTF2RPOLBNPC1
SCHEMBL1399085 0.99 L3MBTL1 (0.60) L3MBTL1MAPTF2RPOLBNPC1
SCHEMBL1399057 0.99 L3MBTL1 (0.60) L3MBTL1MAPTF2RPOLBNPC1
SCHEMBL1399084 0.99 L3MBTL1 (0.60) L3MBTL1MAPTF2RPOLBNPC1
SCHEMBL1399117 0.86 C3AR1 (0.49) L3MBTL1MAPTPOLBHRH3KCNH2
SCHEMBL1399116 0.86 C3AR1 (0.49) L3MBTL1MAPTPOLBHRH3KCNH2
SCHEMBL1399104 0.85 C3AR1 (0.51) L3MBTL1MAPTPOLBHRH3KCNH2
SCHEMBL1399106 0.85 C3AR1 (0.51) L3MBTL1MAPTPOLBHRH3KCNH2
SCHEMBL1399127 0.84 ALDH1A1 (0.61) L3MBTL1MAPTPOLBNPC1RAB9A

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
US-8022064-B2 Phenylpentadienoyl derivatives and their use as PAR 1 antagonists PIERRE FABRE MEDICAMENT (FR) 2011-09-20 US disclosed
EP-2046748-B1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PF MEDICAMENT (FR) 2011-03-02 EP disclosed
US-20100003260-A1 PHENYLPENTADIENOYL DERIVATIVES AND THEIR USE AS PAR 1 ANTAGONISTS PIERRE FABRE MEDICAMENT (FR) 2010-01-07 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 (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 L3MBTL1 2246/4885MAPT 3903/4885F2R 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.