SCHEMBL2384701

SCHEMBL2384701

Cn1ncc(C(=O)N2CC(F)C2)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 11/20 0.50
GLRA1 P23415 1/20 0.38
KMT2A Q03164 1/20 0.36
SPR P35270 1/20 0.35
HTT P42858 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
SCHEMBL14772196 0.87 PDE10A (0.48) PDE10AGLRA1SPRHTT
SCHEMBL11888917 0.87 PDE10A (0.39) PDE10AKMT2A
SCHEMBL9104943 0.83 SPR (0.42) PDE10ASPR
SCHEMBL31233502 0.81 PDE10A (0.43) PDE10AGLRA1SPR
SCHEMBL9106126 0.80 POLB (0.49) PDE10A
SCHEMBL1458202 0.80 PDE10A (0.50) PDE10A
SCHEMBL11889069 0.79 SPR (0.39) PDE10AKMT2ASPRHTT
SCHEMBL1457781 0.79 PLAT (0.43) PDE10AKMT2A
SCHEMBL9104762 0.79 L3MBTL1 (0.51) PDE10AKMT2A
SCHEMBL14672263 0.79 POLB (0.47) PDE10A

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2758396-B1 TRIAZOLOPYRIDINE COMPOUNDS AS PDE10A INHIBITORS HOFFMANN LA ROCHE (CH) 2017-03-29 EP claimed
CN-103827114-B Triazolopyridine compounds as PDE10A inhibitors 霍夫曼-拉罗奇有限公司 2016-08-24 CN claimed
CN-103781768-B Pde10 regulator 霍夫曼-拉罗奇有限公司 2016-08-17 CN claimed
US-9227970-B2 Triazolopyridine compounds HOFFMANN-LA ROCHE, INC. (US) 2016-01-05 US claimed
US-20150099735-A1 TRIAZOLOPYRIDINE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2015-04-09 US claimed
US-8946427-B2 Triazolopyridine compounds HOFFMANN-LA ROCHE INC. (US) 2015-02-03 US claimed
US-20140303141-A1 TRIAZOLOPYRIDINE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2014-10-09 US claimed
EP-2758396-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PDE10A INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-07-30 EP claimed
US-8772510-B2 PDE10 modulators HOFFMANN-LA ROCHE INC. (US) 2014-07-08 US claimed
WO-2013041472-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PDE10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-28 WO claimed
US-20130059833-A1 PDE10 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 US claimed
EP-2758396-B1 TRIAZOLOPYRIDINE COMPOUNDS AS PDE10A INHIBITORS HOFFMANN LA ROCHE (CH) 2017-03-29 EP disclosed
CN-103827114-B Triazolopyridine compounds as PDE10A inhibitors 霍夫曼-拉罗奇有限公司 2016-08-24 CN disclosed
US-9227970-B2 Triazolopyridine compounds HOFFMANN-LA ROCHE, INC. (US) 2016-01-05 US disclosed
EP-2753604-B1 PDE10 MODULATORS HOFFMANN LA ROCHE (CH) 2015-08-19 EP disclosed
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2011-09-29 US disclosed
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2011-09-29 US disclosed
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2011-09-29 US disclosed
WO-2011117264-A1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 WO disclosed
WO-2011117264-A1 N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 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 (4 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-20140303141-A1 TRIAZOLOPYRIDINE COMPOUNDS PDE3A, PDE5A, PDE3B PDE10A 5/4885GLRA1 2930/4885KMT2A 3176/4885
US-20110237564-A1 IMIDAZOPYRIMIDINE DERIVATIVES PDE5A, PDE3B, PDE3A PDE10A 10/4885GLRA1 2730/4885KMT2A 2872/4885
US-20130059833-A1 PDE10 MODULATORS PDE10A, PDE5A, PDE2A PDE10A 1/4885GLRA1 959/4885KMT2A 2193/4885
US-20150099735-A1 TRIAZOLOPYRIDINE COMPOUNDS PDE3A, PDE5A, PDE3B PDE10A 5/4885GLRA1 2930/4885KMT2A 3176/4885

“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.