SCHEMBL8256027

SCHEMBL8256027

CC(C)(C)OC(=O)NCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.56
HRH1 P35367 6/20 0.56
DRD3 P35462 6/20 0.56
DRD1 P21728 5/20 0.56
MAPT P10636 4/20 0.56
MAPK1 P28482 4/20 0.56
LMNA P02545 4/20 0.56
CYP2D6 P10635 4/20 0.56
ADRA2A P08913 4/20 0.56
ADRA2B P18089 4/20 0.56
ADRA2C P18825 4/20 0.56
SLC6A2 P23975 4/20 0.56
HTR2A P28223 4/20 0.56
SLC6A4 P31645 4/20 0.56
HTR2B P41595 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
TP53 P04637 3/20 0.56
CYP3A4 P08684 3/20 0.56
HTR2C P28335 3/20 0.56

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
SCHEMBL31104445 0.90 DRD2 (0.62) DRD2HRH1DRD3DRD1MAPT
SCHEMBL1070098 0.89 FPR2 (0.62) DRD2HRH1DRD3DRD1MAPT
SCHEMBL31104431 0.89 DRD2 (0.59) DRD2HRH1DRD3DRD1MAPT
SCHEMBL13602784 0.88 DRD2 (0.62) DRD2HRH1DRD3DRD1MAPT
SCHEMBL10084512 0.85 DRD2 (0.66) DRD2HRH1DRD3DRD1MAPT
SCHEMBL13602783 0.85 DRD2 (0.58) DRD2HRH1DRD3DRD1MAPT
SCHEMBL10084508 0.84 DRD2 (0.67) DRD2HRH1DRD3DRD1MAPT
SCHEMBL31648578 0.84 DRD2 (0.63) DRD2HRH1DRD3DRD1MAPT
Perphenazine 4-Aminobutyrate SCHEMBL8250036 0.84 DRD2 (0.64) DRD2HRH1DRD3DRD1MAPT
Perphenazine 4-Aminobutyrate SCHEMBL29414098 0.83 DRD2 (0.63) DRD2HRH1DRD3DRD1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130150352-A1 CRYSTALLINE FORMS OF THE TRI-MESYLATE SALT OF PERPHENAZINE-GABA AND PROCESS OF PRODUCING THE SAME RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2013-06-13 US disclosed
US-20130150352-A1 CRYSTALLINE FORMS OF THE TRI-MESYLATE SALT OF PERPHENAZINE-GABA AND PROCESS OF PRODUCING THE SAME RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2013-06-13 US disclosed
US-8377929-B2 Crystalline forms of the tri-mesylate salt of perphenazine-GABA and process of producing the same RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2013-02-19 US disclosed
EP-1888120-B1 NOVEL SALTS OF CONJUGATED PSYCHOTROPIC DRUGS AND PROCESSES OF PREPARING SAME UNIV RAMOT (IL) 2012-12-05 EP disclosed
US-20090298814-A1 Novel salts of conjugated psychotropic drugs and processes of preparing same RAMOT AT TEL AVIV UNIVERISTY LTD (IL) 2009-12-03 US disclosed
US-20090298814-A1 Novel salts of conjugated psychotropic drugs and processes of preparing same RAMOT AT TEL AVIV UNIVERISTY LTD (IL) 2009-12-03 US disclosed
WO-2006131923-A2 NOVEL SALTS OF CONJUGATED PSYCHOTROPIC DRUGS AND PROCESSES OF PREPARING SAME RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2006-12-14 WO 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-20090298814-A1 Novel salts of conjugated psychotropic drugs and processes of preparing same SLC7A1, SLC6A2, SLC18A2 DRD2 114/4885HRH1 1254/4885DRD3 127/4885
US-20130150352-A1 CRYSTALLINE FORMS OF THE TRI-MESYLATE SALT OF PERPHENAZINE-GABA AND PROCESS OF PRODUCING THE SAME DPP4, GABBR1, SLC6A1 DRD2 247/4885HRH1 1008/4885DRD3 377/4885

“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.