SCHEMBL2903541

SCHEMBL2903541

N#Cc1ccccc1/C=C/C(=O)N1CCN(CC2CCCCC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2R P25116 4/20 0.61
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.41
NAMPT P43490 1/20 0.41
GPR183 P32249 1/20 0.41
HPGD P15428 1/20 0.40
C3AR1 Q16581 1/20 0.40
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
CCR1 P32246 1/20 0.39

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
SCHEMBL2903542 1.00 F2R (0.61) F2RMAPTL3MBTL1KMT2AALDH1A1
SCHEMBL2902532 0.83 L3MBTL1 (0.67) F2RMAPTL3MBTL1KMT2AALDH1A1
SCHEMBL2905408 0.83 C3AR1 (0.56) F2RMAPTL3MBTL1KMT2AALDH1A1
SCHEMBL2902111 0.80 ALDH1A1 (0.69) MAPTL3MBTL1KMT2AALDH1A1MEN1
SCHEMBL1399061 0.76 KDM4E (0.44) F2RMAPTL3MBTL1ALDH1A1ATM
SCHEMBL1399064 0.76 KDM4E (0.44) F2RMAPTL3MBTL1ALDH1A1ATM
SCHEMBL10300784 0.75 TDP1 (0.57) ALDH1A1NAMPTGPR183C3AR1LMNA
SCHEMBL2902366 0.75 TDP1 (0.57) ALDH1A1NAMPTGPR183C3AR1LMNA
SCHEMBL1399036 0.75 F2R (0.44) F2RMAPTL3MBTL1ALDH1A1GPR183
SCHEMBL1399035 0.75 F2R (0.44) F2RMAPTL3MBTL1ALDH1A1GPR183

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
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-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 F2R 1/4885MAPT 4777/4885L3MBTL1 2597/4885
US-20120232097-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR-1 ANTAGONISTS F2R, F2RL1, F2RL3 F2R 1/4885MAPT 4777/4885L3MBTL1 2597/4885

“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.