SCHEMBL14536737

SCHEMBL14536737

CCc1nc(C2CC(N3CCN(C)CC3)C2)n2ccnc(N)c12

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 5/20 0.59
IGF1R P08069 15/20 0.54
CYP3A4 P08684 5/20 0.54
MAPK3 P27361 1/20 0.54
MAPK1 P28482 1/20 0.54
MAPK6 Q16659 1/20 0.54

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
SCHEMBL19264070 0.86 TNK2 (0.63) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL398156 0.84 TNK2 (0.61) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL10189260 0.84 TNK2 (0.61) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL2967554 0.84 TNK2 (0.61) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL14536933 0.77 TNK2 (0.59) TNK2IGF1RMAPK3MAPK1
SCHEMBL19264282 0.74 TNK2 (0.50) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL1129353 0.74 TNK2 (1.00) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL4360606 0.74 TNK2 (1.00) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL23834450 0.74 TNK2 (0.50) TNK2IGF1RCYP3A4MAPK3MAPK1
SCHEMBL23834448 0.74 TNK2 (0.50) 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
WO-2007061737-A2 FUSED BICYCLIC mTOR INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2007-05-31 WO disclosed