SCHEMBL19264285

SCHEMBL19264285

CC(=O)N1CCN(C2CC(c3nc(C)c4c(N)nccn34)C2)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 5/20 0.48
IGF1R P08069 11/20 0.45
CYP3A4 P08684 5/20 0.45
MAPK3 P27361 1/20 0.45
MAPK1 P28482 1/20 0.45
MAPK6 Q16659 1/20 0.45
RET P07949 2/20 0.40
KIF5B P33176 2/20 0.40
RAF1 P04049 1/20 0.40
SRC P12931 1/20 0.40
KDR P35968 1/20 0.40
BTK Q06187 1/20 0.40

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
SCHEMBL400538 0.89 TNK2 (0.47) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL6937533 0.89 TNK2 (0.47) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL19264064 0.87 TNK2 (0.38) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL19264070 0.85 TNK2 (0.63) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL2574212 0.85 TNK2 (0.43) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL12296405 0.80 TNK2 (0.48) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL593129 0.79 RAF1 (0.69) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL15070958 0.79 TNK2 (0.51) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL593128 0.79 RAF1 (0.69) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL402204 0.79 TNK2 (0.37) TNK2IGF1RCYP3A4MAPK3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2168968-B1 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI PHARMACEUTICALS LLC (US) 2017-08-23 EP disclosed