SCHEMBL3308087

SCHEMBL3308087

N#Cc1ccc(Nc2nc3cccc(-c4cccc(O)c4)n3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 4/20 0.56
JAK2 O60674 11/20 0.51
JAK3 P52333 6/20 0.51
PTK2 Q05397 5/20 0.51
ABCB1 P08183 2/20 0.50
ABCC1 P33527 2/20 0.50
ABCG2 Q9UNQ0 2/20 0.50
TTK P33981 1/20 0.49
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
JAK1 P23458 1/20 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
SCHEMBL2145008 0.87 JAK2 (0.57) JAK2JAK3PTK2ADORA2AADORA1
SCHEMBL3303560 0.86 TTK (0.48) EGLN2JAK2ABCB1ABCC1ABCG2
SCHEMBL2145028 0.84 EGLN2 (0.65) EGLN2JAK2JAK3PTK2TTK
SCHEMBL2144377 0.84 JAK2 (0.52) JAK2JAK3PTK2JAK1
SCHEMBL2145167 0.83 ADORA2B (0.56) EGLN2JAK2JAK3PTK2ADORA1
SCHEMBL3207034 0.83 JAK2 (0.69) EGLN2JAK2JAK3PTK2
SCHEMBL2143966 0.83 JAK2 (0.67) JAK2JAK3PTK2JAK1
SCHEMBL2144259 0.82 JAK2 (0.54) JAK2JAK3PTK2JAK1
SCHEMBL2144323 0.80 JAK2 (0.55) JAK2JAK3PTK2JAK1
SCHEMBL7975885 0.80 EGLN2 (0.80) EGLN2JAK2JAK3PTK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344494-B1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARM LLC (US) 2016-04-20 EP disclosed
US-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BAHMANYAR SOGOLE (US) 2013-01-03 US disclosed
US-8299056-B2 Aminotriazolopyridines, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2012-10-30 US disclosed
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2010-04-15 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-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 EGLN2 564/4885JAK2 26/4885JAK3 86/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 EGLN2 564/4885JAK2 26/4885JAK3 86/4885

“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.