SCHEMBL3305282

SCHEMBL3305282

CC1(C)C(=O)Nc2cc(Nc3nc4cccc(CC5CCOC5)n4n3)ccc21.NC(=O)c1ccc(Nc2nc3cccc(NC4CCCCC4)n3n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.35
JAK1 P23458 2/20 0.35
SYK P43405 7/20 0.33
CDK2 P24941 5/20 0.33
CCNA2 P20248 3/20 0.33
CDK1 P06493 3/20 0.33
CCNA1 P78396 2/20 0.33
CCNB2 O95067 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNB3 Q8WWL7 1/20 0.33
TBK1 Q9UHD2 2/20 0.32
SRC P12931 1/20 0.32
GSK3A P49840 1/20 0.32
MAPK14 Q16539 1/20 0.32
NEK2 P51955 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
CCNE1 P24864 1/20 0.31
CCND3 P30281 1/20 0.31

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
SCHEMBL3304644 0.86 JAK2 (0.43) JAK2JAK1SYKTBK1SRC
SCHEMBL3297815 0.86 JAK2 (0.43) JAK2JAK1SYKTBK1SRC
SCHEMBL2144919 0.86 JAK2 (0.43) JAK2JAK1SYKTBK1SRC
SCHEMBL2144254 0.82 JAK2 (0.41) JAK2JAK1SYKTBK1SRC
SCHEMBL2144633 0.81 JAK2 (0.44) JAK2JAK1SYKTBK1SRC
SCHEMBL2144636 0.81 JAK2 (0.44) JAK2JAK1SYKTBK1SRC
SCHEMBL2144106 0.80 JAK2 (0.42) JAK2JAK1SYKTBK1SRC
SCHEMBL2144667 0.77 SYK (0.49) JAK2JAK1SYKCDK2CCNA2
SCHEMBL2145162 0.76 JAK2 (0.40) JAK2JAK1SYKTBK1SRC
SCHEMBL2145278 0.76 JAK2 (0.39) JAK2JAK1SYKTBK1MAPK14

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
US-8299056-B2 Aminotriazolopyridines, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2012-10-30 US claimed
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2010-04-15 US claimed
EP-2344494-B1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARM LLC (US) 2016-04-20 EP 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-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 JAK2 26/4885JAK1 69/4885SYK 387/4885

“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.