SCHEMBL3769331

SCHEMBL3769331

Clc1nc2ccccn2c1-c1ccnc(Nc2ccc3c(c2)CCNC3)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.52
EGFR P00533 2/20 0.49
ERBB2 P04626 2/20 0.49
IGF1R P08069 2/20 0.49
CDK4 P11802 2/20 0.48
CCNE1 P24864 1/20 0.48
ACVR1 Q04771 3/20 0.48
BRAF P15056 4/20 0.45
KDR P35968 2/20 0.44
AURKB Q96GD4 2/20 0.44
PLK4 O00444 1/20 0.44
CHEK1 O14757 1/20 0.44
PRKD3 O94806 1/20 0.44
LCK P06239 1/20 0.44
CSF1R P07333 1/20 0.44
ROS1 P08922 1/20 0.44
KIT P10721 1/20 0.44
FGFR1 P11362 1/20 0.44
SRC P12931 1/20 0.44
FLT1 P17948 1/20 0.44

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
SCHEMBL3764924 0.96 CDK2 (0.52) CDK2EGFRERBB2IGF1RCDK4
SCHEMBL3767705 0.82 BRAF (0.64) CDK2EGFRERBB2IGF1RCDK4
SCHEMBL3760568 0.79 CDK2 (0.74) CDK2EGFRIGF1RCDK4CCNE1
SCHEMBL3760761 0.77 CDK2 (0.66) CDK2IGF1RCDK4CCNE1SYK
SCHEMBL3766490 0.77 IGF1R (0.53) CDK2EGFRERBB2IGF1RCDK4
SCHEMBL3762095 0.74 CDK2 (0.54) CDK2EGFRERBB2IGF1RCDK4
SCHEMBL3760297 0.74 CDK2 (0.59) CDK2IGF1RCDK4CCNE1KDR
SCHEMBL3766752 0.74 IGF1R (0.50) CDK2EGFRERBB2IGF1RCDK4
SCHEMBL3757034 0.73 CDK2 (0.66) CDK2IGF1RCDK4CCNE1BRAF
SCHEMBL3767176 0.73 CDK2 (0.62) CDK2IGF1RCDK4CCNE1ACVR1

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 4 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 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 CDK2 2/4885EGFR 328/4885ERBB2 58/4885

“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.