SCHEMBL6925353

SCHEMBL6925353

CCOc1c(F)cccc1C1CCNCC1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.69
SLC6A4 P31645 12/20 0.69
HTR1A P08908 11/20 0.69
SLC6A3 Q01959 8/20 0.69
HTR6 P50406 4/20 0.48
HTR2C P28335 4/20 0.46

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
SCHEMBL5020033 0.83 HTR1A (0.67) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL19262554 0.81 SLC6A4 (0.47) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL10819398 0.80 SLC6A4 (0.46) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL13770273 0.78 HTR1A (0.80) SLC6A2SLC6A4HTR1ASLC6A3
SCHEMBL3321425 0.77 SLC6A2 (0.70) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL5669748 0.75 SLC6A2 (0.68) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL6638482 0.74 HTR2C (0.69) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL23228756 0.74 HTR1A (0.59) SLC6A2SLC6A4HTR1ASLC6A3
SCHEMBL27794133 0.74 HTR1A (0.55) SLC6A2SLC6A4HTR1ASLC6A3HTR6
SCHEMBL31159751 0.74 SLC6A2 (0.61) SLC6A2SLC6A4HTR1ASLC6A3HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120184525-A1 1,2,3-TRIAZOLO [4,3-A] PYRIDINE DERIVATIVES AND THIER USE FOR THE TREATMENT OF PREVENTION OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS ADDEX PHARMA S.A. (CH) 2012-07-19 US disclosed
WO-2010130424-A9 1,2,4-TRIAZOLO [4,3-A] PYRIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OR PREVENTION OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC (US) 2011-01-27 WO disclosed
WO-2010130424-A1 1,2,3-TRIAZOLO [4,3-A] PYRIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OR PREVENTION OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC (US) 2010-11-18 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 (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-20120184525-A1 1,2,3-TRIAZOLO [4,3-A] PYRIDINE DERIVATIVES AND THIER USE FOR THE TREATMENT OF PREVENTION OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GRM2, GRM3, GRM1 SLC6A2 177/4885SLC6A4 138/4885HTR1A 41/4885

“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.