SCHEMBL265124

SCHEMBL265124

C[CH]CC(N)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.39
TACR1 P25103 3/20 0.38
TAAR1 Q96RJ0 1/20 0.37
CACNA1F O60840 1/20 0.36
CACNA1D Q01668 1/20 0.36
CACNA1S Q13698 1/20 0.36
CACNA1C Q13936 1/20 0.36
IDO1 P14902 2/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
GRM8 O00222 1/20 0.35
GRM4 Q14833 1/20 0.35
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
KIF11 P52732 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35

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
SCHEMBL266165 0.80 PNMT (0.51) TACR1TAAR1CACNA1FCACNA1DCACNA1S
SCHEMBL7928876 0.79 DPP4 (0.41) IDO1
SCHEMBL1727842 0.79 SLC6A4 (0.52) PDE2ATACR1TAAR1CACNA1FCACNA1D
SCHEMBL3171890 0.79 SLC6A4 (0.52) PDE2ATACR1TAAR1CACNA1FCACNA1D
SCHEMBL1729033 0.79 SLC6A4 (0.52) PDE2ATACR1TAAR1CACNA1FCACNA1D
Hydrochloric Acid SCHEMBL17766990 0.77 SLC6A4 (0.50) PDE2ATACR1TAAR1CACNA1FCACNA1D
Hydrochloric Acid SCHEMBL20791454 0.77 SLC6A4 (0.50) PDE2ATACR1TAAR1CACNA1FCACNA1D
Hydrochloric Acid SCHEMBL4936793 0.77 SLC6A4 (0.50) PDE2ATACR1TAAR1CACNA1FCACNA1D
SCHEMBL9903763 0.76 TAAR1 (0.47) PDE2ATACR1TAAR1CACNA1FCACNA1D
SCHEMBL3602797 0.76 PDE2A (0.43) PDE2ATACR1TAAR1CACNA1FCACNA1D

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-8431378-B2 Aminotransferase, gene encoding the same, and methods of using them KANEKA CORPORATION (JP) 2013-04-30 US disclosed
US-20120164724-A1 NOVEL AMINOTRANSFERASE, GENE ENCODING THE SAME, AND METHODS OF USING THEM KANEKA CORPORATION (JP) 2012-06-28 US disclosed
US-8133705-B2 Aminotransferase, gene encoding the same, and method of using them KANEKA CORPORATION (JP) 2012-03-13 US disclosed
US-20100285544-A1 Novel aminotransferase, gene encoding the same, and method of using them KANEKA CORPORATION (JP) 2010-11-11 US disclosed
EP-1889907-B1 NOVEL AMINO GROUP TRANSFERASE, GENE ENCODING THE SAME AND METHOD OF USING THE SAME KANEKA CORP (JP) 2009-09-02 EP disclosed
EP-1889907-A1 NOVEL AMINO GROUP TRANSFERASE, GENE ENCODING THE SAME AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2008-02-20 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 (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-20100285544-A1 Novel aminotransferase, gene encoding the same, and method of using them BCAT1, AGXT, ALDH7A1 PDE2A 2987/4885TACR1 2560/4885TAAR1 1322/4885

“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.