SCHEMBL15070958

SCHEMBL15070958

CC(=O)N1CCN(C2CC(c3nc(-c4nc5ccccc5[nH]4)c4c(N)nccn34)C2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 7/20 0.51
RAF1 P04049 2/20 0.50
SRC P12931 2/20 0.50
IGF1R P08069 12/20 0.49
CYP3A4 P08684 5/20 0.49
MAPK3 P27361 1/20 0.49
MAPK1 P28482 1/20 0.49
MAPK6 Q16659 1/20 0.49
PDPK1 O15530 1/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.46
INSR P06213 1/20 0.46
KDR P35968 1/20 0.46
MAP2K1 Q02750 1/20 0.46

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
SCHEMBL15070961 0.89 TNK2 (0.63) TNK2RAF1SRCIGF1RCYP3A4
SCHEMBL593128 0.85 RAF1 (0.69) TNK2RAF1SRCIGF1RCYP3A4
SCHEMBL593129 0.85 RAF1 (0.69) TNK2RAF1SRCIGF1RCYP3A4
SCHEMBL15070957 0.82 TNK2 (0.59) TNK2RAF1SRCIGF1RPDPK1
SCHEMBL15070959 0.80 TNK2 (0.61) TNK2RAF1SRCIGF1RCYP3A4
SCHEMBL19264285 0.79 TNK2 (0.48) TNK2RAF1SRCIGF1RCYP3A4
SCHEMBL594237 0.78 TNK2 (0.63) TNK2IGF1RCYP3A4
SCHEMBL19264067 0.78 IGF1R (0.81) IGF1RCYP3A4MAPK3MAPK1MAPK6
SCHEMBL10225510 0.78 IGF1R (0.81) IGF1RCYP3A4MAPK3MAPK1MAPK6
SCHEMBL6937533 0.78 TNK2 (0.47) TNK2RAF1SRCIGF1RCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130165651-A1 FUSED BICYCLIC mTOR INHIBITORS OSI Pharmaceuticals, LLC 2013-06-27 US disclosed
US-20130165651-A1 FUSED BICYCLIC mTOR INHIBITORS OSI Pharmaceuticals, LLC 2013-06-27 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 (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-20130165651-A1 FUSED BICYCLIC mTOR INHIBITORS MTOR, RICTOR, MAPKAP1 TNK2 669/4885RAF1 260/4885SRC 294/4885

“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.