SCHEMBL3304420

SCHEMBL3304420

Cc1n[nH]c2cc(Nc3nc4ccnc(NC5CCC(O)CC5)n4n3)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 4/20 0.40
MAPK9 P45984 3/20 0.40
MAPK10 P53779 2/20 0.40
JAK2 O60674 5/20 0.39
SYK P43405 5/20 0.39
RET P07949 3/20 0.39
LCK P06239 3/20 0.39
TYRO3 Q06418 2/20 0.39
DAPK3 O43293 2/20 0.39
PAK4 O96013 2/20 0.39
ABL1 P00519 2/20 0.39
LTK P29376 2/20 0.39
GRK5 P34947 2/20 0.39
KDR P35968 2/20 0.39
CSNK1A1 P48729 2/20 0.39
TNK2 Q07912 2/20 0.39
MAP4K2 Q12851 2/20 0.39
STK16 O75716 1/20 0.39
MAP4K4 O95819 1/20 0.39
FYN P06241 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
SCHEMBL2144431 0.86 MAPK8 (0.36) MAPK8MAPK9MAPK10JAK2SYK
SCHEMBL2144426 0.86 MAPK8 (0.36) MAPK8MAPK9MAPK10JAK2SYK
SCHEMBL2145231 0.86 MAPK8 (0.36) MAPK8MAPK9MAPK10JAK2SYK
SCHEMBL3297722 0.83 JAK2 (0.37) JAK2SYKRETKDRFLT3
SCHEMBL2144097 0.79 JAK2 (0.36) JAK2SYKKDRPTK2ALK
SCHEMBL2145041 0.79 JAK2 (0.36) JAK2SYKKDRPTK2ALK
SCHEMBL2144104 0.79 JAK2 (0.36) JAK2SYKKDRPTK2ALK
SCHEMBL13391277 0.79 MAPK8 (0.38) MAPK8MAPK9MAPK10JAK2LCK
SCHEMBL2144743 0.79 MAPK8 (0.38) MAPK8MAPK9MAPK10JAK2LCK
SCHEMBL2144748 0.79 MAPK8 (0.38) MAPK8MAPK9MAPK10JAK2LCK

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-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 MAPK8 189/4885MAPK9 170/4885MAPK10 367/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 MAPK8 189/4885MAPK9 170/4885MAPK10 367/4885

“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.