SCHEMBL2903101

SCHEMBL2903101

O=C(C=CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.51
FAAH O00519 3/20 0.50
GPR183 P32249 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.47
AKR1C3 P42330 1/20 0.47
DRD4 P21917 3/20 0.45
DRD2 P14416 2/20 0.45
MGLL Q99685 1/20 0.45
F2R P25116 1/20 0.45
DRD3 P35462 1/20 0.44

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
SCHEMBL2904068 0.90 LMNA (0.51) FAAHMEN1KMT2AATM
SCHEMBL2905103 0.90 F2R (0.57) FAAHGPR183MEN1KMT2AATM
SCHEMBL2905713 0.88 ALDH1A1 (0.46) SIGMAR1FAAHF2R
SCHEMBL2906083 0.88 SIGMAR1 (0.57) SIGMAR1FAAHMEN1KMT2AATM
SCHEMBL2905724 0.86 FAAH (0.53) SIGMAR1FAAHMEN1KMT2AATM
SCHEMBL2907155 0.83 ALDH1A1 (0.56) FAAHMEN1KMT2ADRD4DRD2
SCHEMBL2903285 0.83 LMNA (0.50) SIGMAR1FAAHGPR183MEN1KMT2A
SCHEMBL2909313 0.83 FAAH (0.52) SIGMAR1FAAHGPR183MEN1KMT2A
SCHEMBL4379112 0.83 P2RX7 (0.53) SIGMAR1DRD2DRD3
SCHEMBL2906184 0.81 ALDH1A1 (0.54) FAAHGPR183MEN1KMT2AATM

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 SIGMAR1 464/4885FAAH 506/4885GPR183 891/4885
US-20120232097-A1 CINNAMOYL-PIPERAZINE DERIVATIVES AND THEIR USE AS PAR-1 ANTAGONISTS F2R, F2RL1, F2RL3 SIGMAR1 464/4885FAAH 506/4885GPR183 891/4885

“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.