SCHEMBL3758768

SCHEMBL3758768

COc1ccc(CN(C)CCO)cc1Nc1nccc(-c2c(-c3ccc(OCc4ccccc4)c(OC)c3)nc3ccccn23)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 8/20 0.52
PRKD3 O94806 2/20 0.52
MAP4K4 O95819 2/20 0.52
LCK P06239 2/20 0.52
FYN P06241 2/20 0.52
CSF1R P07333 2/20 0.52
RET P07949 2/20 0.52
MET P08581 2/20 0.52
ROS1 P08922 2/20 0.52
FLT1 P17948 2/20 0.52
KDR P35968 2/20 0.52
MAP4K2 Q12851 2/20 0.52
STK3 Q13188 2/20 0.52
TAOK1 Q7L7X3 2/20 0.52
AURKB Q96GD4 2/20 0.52
MAP4K5 Q9Y4K4 2/20 0.52
PAK4 O96013 1/20 0.52
ABL1 P00519 1/20 0.52
GSK3B P49841 1/20 0.52
BTK Q06187 1/20 0.52

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
SCHEMBL3767846 0.90 CDK19 (0.59) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3767735 0.88 CDK19 (0.47) IGF1RCDK19ALKINSREGFR
SCHEMBL3726694 0.86 IGF1R (0.48) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3762580 0.86 CDK19 (0.62) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3760802 0.84 CDK2 (0.47) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3756628 0.84 IGF1R (0.48) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3764610 0.84 CDK19 (0.48) IGF1RCDK19ALKINSREGFR
SCHEMBL3767817 0.83 IGF1R (0.56) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3771416 0.83 IGF1R (0.46) IGF1RPRKD3MAP4K4LCKFYN
SCHEMBL3725890 0.83 CDK19 (0.64) IGF1RPRKD3MAP4K4LCKFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435436-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-07-30 EP claimed
US-8354422-B2 Pyrimidine inhibitors of kinase activity ABBOTT LABORATORIES INC. (US) 2013-01-15 US claimed
WO-2010138576-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO claimed
US-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity ABBOTT LABORATORIES (US) 2010-12-02 US claimed
EP-2435436-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-07-30 EP disclosed
US-8354422-B2 Pyrimidine inhibitors of kinase activity ABBOTT LABORATORIES INC. (US) 2013-01-15 US disclosed
WO-2010138576-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO disclosed
US-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity ABBOTT LABORATORIES (US) 2010-12-02 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-20100305126-A1 Pyrimidine Inhibitors of Kinase Activity IGF1R, CDK2, TK1 IGF1R 1/4885PRKD3 186/4885MAP4K4 305/4885

“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.