SCHEMBL2910147

SCHEMBL2910147

O=C(C=Cc1c(F)cccc1F)N1CCN(Cc2cccc(Cl)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.60
ACHE P22303 1/20 0.60
KDM4E B2RXH2 1/20 0.60
ALDH1A1 P00352 1/20 0.60
TSHR P16473 1/20 0.60
HTT P42858 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
GPR183 P32249 7/20 0.56
ATM Q13315 1/20 0.54
F2R P25116 1/20 0.54
FAAH O00519 1/20 0.53
CACNA1G O43497 1/20 0.52
SIGMAR1 Q99720 1/20 0.52
POLB P06746 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL2908746 0.90 MEN1 (0.65) TDP1MEN1KMT2AGPR183F2R
SCHEMBL10300779 0.89 MEN1 (0.64) TDP1ACHEALDH1A1HTTSMN1; SMN2
SCHEMBL2906207 0.88 TDP1 (0.57) TDP1ACHEKDM4EALDH1A1HTT
SCHEMBL2910049 0.87 ALDH1A1 (0.65) TDP1ACHEKDM4EALDH1A1HTT
SCHEMBL10300778 0.86 GPR183 (0.67) TDP1ACHEMEN1KMT2AGPR183
SCHEMBL2902830 0.86 GPR183 (0.67) TDP1ACHEMEN1KMT2AGPR183
SCHEMBL2905865 0.84 GPR183 (0.63) TDP1ACHEKDM4EALDH1A1HTT
SCHEMBL17938751 0.84 MEN1 (0.78) TDP1ACHEKDM4EALDH1A1TSHR
SCHEMBL17938752 0.84 MEN1 (0.78) TDP1ACHEKDM4EALDH1A1TSHR
SCHEMBL2903325 0.83 GPR183 (0.61) TDP1ACHEKDM4EALDH1A1HTT

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-20120232097-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR-1 ANTAGONISTS PEREZ MICHEL (FR) 2012-09-13 US claimed
EP-2041104-B1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR- I ANTAGONISTS PF MEDICAMENT (FR) 2010-08-18 EP claimed
US-20090176803-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR-1 ANTAGONISTS PIERRE FABRE MEDICAMENT (FR) 2009-07-09 US claimed
EP-2041104-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR- I ANTAGONISTS Pierre Fabre Medicament (FR) 2009-04-01 EP claimed
WO-2007147824-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR- I ANTAGONISTS PIERRE FABRE MEDICAMENT (FR) 2007-12-27 WO claimed
EP-2041104-B1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR- I ANTAGONISTS PF MEDICAMENT (FR) 2010-08-18 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 (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-20090176803-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR-1 ANTAGONISTS F2R, F2RL1, F2RL3 TDP1 1913/4885ACHE 3506/4885KDM4E 3494/4885
US-20120232097-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR-1 ANTAGONISTS F2R, F2RL1, F2RL3 TDP1 1913/4885ACHE 3506/4885KDM4E 3494/4885

“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.