SCHEMBL16554666

SCHEMBL16554666

Cc1noc(Cn2nnc3c(N4CC[C@](C)(O)C4)nc(N4CCOCC4)nc32)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 19/20 1.00
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL16554814 1.00 CNR2 (1.00) CNR2ALDH1A1LMNAPOLBGAA
SCHEMBL14911897 0.84 CNR2 (0.72) CNR2
SCHEMBL14911900 0.84 CNR2 (0.72) CNR2
SCHEMBL14912129 0.84 CNR2 (0.72) CNR2
SCHEMBL16554610 0.79 CNR2 (1.00) CNR2ALDH1A1GAA
SCHEMBL16554453 0.79 CNR2 (1.00) CNR2ALDH1A1GAA
SCHEMBL16554450 0.79 CNR2 (1.00) CNR2ALDH1A1GAA
SCHEMBL16554870 0.79 CNR2 (0.71) CNR2ALDH1A1
SCHEMBL16554754 0.79 CNR2 (0.71) CNR2ALDH1A1
SCHEMBL16554756 0.79 CNR2 (0.71) CNR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3483163-B1 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES AS CB2 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2021-06-23 EP claimed
EP-3483163-A2 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES AS CB2 RECEPTOR ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2019-05-15 EP claimed
US-9593123-B2 Triazolo[4,5-D]pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 2017-03-14 US claimed
EP-3041843-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2016-07-13 EP claimed
US-20160168158-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2016-06-16 US claimed
WO-2015032769-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-03-12 WO claimed
EP-3943497-A1 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES AS CB2 RECEPTOR ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2022-01-26 EP disclosed
EP-3483163-B1 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES AS CB2 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2021-06-23 EP disclosed
EP-3483163-A2 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES AS CB2 RECEPTOR ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2019-05-15 EP disclosed
EP-3041843-B1 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES AS CB2 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2019-01-02 EP disclosed
US-9593123-B2 Triazolo[4,5-D]pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 2017-03-14 US disclosed
US-9593123-B2 Triazolo[4,5-D]pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 2017-03-14 US disclosed
US-9593123-B2 Triazolo[4,5-D]pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 2017-03-14 US disclosed
EP-3041843-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2016-07-13 EP disclosed
US-20160168158-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2016-06-16 US disclosed
US-20160168158-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2016-06-16 US disclosed
US-20160168158-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2016-06-16 US disclosed
WO-2015032769-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-03-12 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-20160168158-A1 NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES TYMS, TYMP, P2RX4 CNR2 285/4885ALDH1A1 724/4885LMNA 4369/4885

“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.