SCHEMBL3299659

SCHEMBL3299659

Cc1ccc(S(=O)(=O)n2ccc3cc(Nc4nc5cccc(CN6CCNC(=O)C6)n5n4)cnc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
JAK2 O60674 12/20 0.38
JAK1 P23458 1/20 0.38
HTR6 P50406 2/20 0.36
JAK3 P52333 10/20 0.35
PTK2 Q05397 10/20 0.35
FGFR4 P22455 2/20 0.34
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
IKBKB O14920 1/20 0.34
CHUK O15111 1/20 0.34
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33

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
SCHEMBL3305067 0.78 JAK2 (0.44) JAK2JAK1JAK3PTK2PDCD1
SCHEMBL2144634 0.74 JAK2 (0.44) JAK2JAK1JAK3PTK2PDCD1
SCHEMBL2145314 0.72 JAK1 (0.46) JAK2JAK1
SCHEMBL2144092 0.71 JAK2 (0.42) JAK2JAK1JAK3PTK2PDCD1
SCHEMBL2144548 0.71 JAK2 (0.42) JAK2JAK1JAK3PTK2PDCD1
SCHEMBL2144840 0.71 JAK2 (0.46) JAK2JAK1JAK3PTK2IKBKB
SCHEMBL3304606 0.71 JAK2 (0.42) JAK2JAK1JAK3PTK2PDCD1
SCHEMBL2144266 0.70 JAK2 (0.42) JAK2JAK1JAK3PTK2EGFR
SCHEMBL3302056 0.69 JAK2 (0.42) JAK2JAK1JAK3PTK2PDCD1
SCHEMBL2144000 0.69 JAK2 (0.41) JAK2JAK1JAK3PTK2EGFR

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 L3MBTL1 2124/4885JAK2 26/4885JAK1 69/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 L3MBTL1 2124/4885JAK2 26/4885JAK1 69/4885

“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.