SCHEMBL17888262

SCHEMBL17888262

CC1=CCN(C(=O)C2CCOC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 16/20 0.53
GRM5 P41594 1/20 0.43
KMT2A Q03164 1/20 0.40
CNR2 P34972 1/20 0.40
EPHX2 P34913 1/20 0.39

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
SCHEMBL17888258 0.91 NAMPT (0.51) NAMPTGRM5CNR2
SCHEMBL17886600 0.83 NAMPT (0.48) NAMPTGRM5CNR2EPHX2
SCHEMBL17342884 0.83 KEAP1 (0.43) NAMPT
SCHEMBL21078128 0.83 NAMPT (0.50) NAMPTGRM5EPHX2
SCHEMBL25628757 0.82 NAMPT (0.47) NAMPTGRM5CNR2
SCHEMBL17888264 0.80 KEAP1 (0.51) NAMPTKMT2A
SCHEMBL19226370 0.80 KEAP1 (0.48) NAMPTKMT2A
SCHEMBL17888277 0.79 KEAP1 (0.54) NAMPTKMT2A
SCHEMBL7920857 0.78 NAMPT (0.47) NAMPTGRM5
SCHEMBL17888257 0.77 GPR119 (0.42)

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
EP-3041841-B1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2019-06-05 EP disclosed
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-08-10 US disclosed
US-20160185780-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-06-30 US 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-20160185780-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 NAMPT 1885/4885GRM5 1825/4885KMT2A 1797/4885
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 NAMPT 1885/4885GRM5 1825/4885KMT2A 1797/4885

“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.