SCHEMBL528962

SCHEMBL528962

CN1CCN(C(=O)COc2cccc(C=O)c2)CC1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.70
POLB P06746 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
HTR1A P08908 6/20 0.57
HTR1D P28221 6/20 0.57
HTR1B P28222 6/20 0.57
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
RECQL P46063 1/20 0.52
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.50
LMNA P02545 1/20 0.50
FKBP1A P62942 1/20 0.49

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
SCHEMBL15156267 0.88 MEN1 (0.60) GAAPOLBL3MBTL1TDP1MEN1
SCHEMBL3425520 0.86 GAA (0.53) GAAPOLBL3MBTL1TDP1MEN1
SCHEMBL15156731 0.85 TPSAB1 (0.58) GAAL3MBTL1MEN1KMT2ARECQL
SCHEMBL528448 0.85 ALDH1A1 (0.72) POLBL3MBTL1KMT2ARECQLALDH1A1
SCHEMBL15156208 0.84 GAA (0.51) GAAPOLBL3MBTL1TDP1HTR1A
SCHEMBL15156397 0.84 ALDH1A1 (0.71) GAAPOLBL3MBTL1TDP1HTR1A
SCHEMBL15156212 0.83 MEN1 (0.50) GAAPOLBTDP1MEN1KMT2A
SCHEMBL15134809 0.83 GAA (0.76) GAAPOLBL3MBTL1TDP1HTR1A
SCHEMBL15134821 0.82 GAA (0.74) GAAPOLBL3MBTL1TDP1HTR1A
SCHEMBL14578666 0.81 L3MBTL1 (0.89) GAAPOLBL3MBTL1TDP1KEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9238656-B2 Imidazo[4,5-b]pyridine derivatives as ALK and JAK modulators for the treatment of proliferative disorders CEPHALON, INC. (US) 2016-01-19 US disclosed
EP-2809671-B1 IMIDAZO [4, 5 - B]PYRIDINE DERIVATIVES AS ALK AND JAK MODULATORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CEPHALON INC (US) 2016-01-13 EP disclosed
EP-2809671-A1 IMIDAZO [4, 5 - B]PYRIDINE DERIVATIVES AS ALK AND JAK MODULATORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS Cephalon, Inc. (US) 2014-12-10 EP disclosed
US-20140350011-A1 Imidazo[4,5-b]pyridine Derivatives as ALK and JAK Modulators for the Treatment of Proliferative Disorders CEPHALON, INC. 2014-11-27 US disclosed
WO-2013116291-A1 IMIDAZO [4, 5 - B] PYRIDINE DERIVATIVES AS ALK AND JAK MODULATORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CEPHALON, INC. (US) 2013-08-08 WO disclosed
EP-2597953-A1 METHOD FOR TREATING OPHTHALMIC DISEASES USING KINASE INHIBITOR COMPOUNDS IN PRODRUG FORMS Inspire Pharmaceuticals, Inc. (US) 2013-06-05 EP disclosed
US-20130131059-A1 METHOD FOR TREATING OPHTHALMIC DISEASES USING KINASE INHIBITOR COMPOUNDS IN PRODRUG FORMS INSPIRE PHARMACEUTICALS, INC. (US) 2013-05-23 US disclosed
WO-2012015760-A1 METHOD FOR TREATING OPHTHALMIC DISEASES USING KINASE INHIBITOR COMPOUNDS IN PRODRUG FORMS INSPIRE PHARMACEUTICALS, INC. (US) 2012-02-02 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 (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-20130131059-A1 METHOD FOR TREATING OPHTHALMIC DISEASES USING KINASE INHIBITOR COMPOUNDS IN PRODRUG FORMS ROCK1, ROCK2, CIT GAA 1158/4885POLB 2588/4885L3MBTL1 4254/4885
US-20140350011-A1 Imidazo[4,5-b]pyridine Derivatives as ALK and JAK Modulators for the Treatment of Proliferative Disorders JAK1, ALK, JAK2 GAA 2612/4885POLB 741/4885L3MBTL1 3318/4885

“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.