SCHEMBL398892

SCHEMBL398892

CC(=O)NC[C@H]1CC[C@H](c2ncc3c(N)nc(-c4ccc5ccc(-c6ccccc6)nc5c4)cn32)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 11/20 0.45
INSR P06213 4/20 0.42
KDR P35968 3/20 0.42
MAP2K1 Q02750 2/20 0.42
EGFR P00533 2/20 0.42
PDPK1 O15530 1/20 0.42
ABL1 P00519 1/20 0.42
RAF1 P04049 1/20 0.42
SRC P12931 1/20 0.42
DKK1 O94907 1/20 0.42
CYP3A4 P08684 5/20 0.42
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
MAPK3 P27361 2/20 0.40
MAPK1 P28482 2/20 0.40
RIPK2 O43353 1/20 0.40
ROCK2 O75116 1/20 0.40
LATS1 O95835 1/20 0.40
LCK P06239 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
SCHEMBL4070273 0.92 IGF1R (0.45) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL401993 0.90 IGF1R (0.43) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL401241 0.89 IGF1R (0.44) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL400822 0.87 IGF1R (0.43) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL400901 0.87 IGF1R (0.41) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL4073244 0.85 IGF1R (0.51) IGF1RINSRKDRMAP2K1CYP3A4
SCHEMBL1683067 0.84 IGF1R (0.45) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL18952119 0.79 IGF1R (0.61) IGF1RINSRKDRMAP2K1CYP3A4
SCHEMBL398893 0.79 IGF1R (0.73) IGF1RINSRKDRMAP2K1EGFR
SCHEMBL13812661 0.79 IGF1R (0.73) IGF1RINSRKDRMAP2K1EGFR

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 12 patents. 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
US-8735405-B2 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI Pharmaceuticals, LLC (US) 2014-05-27 US disclosed
US-8367826-B2 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI Pharmaceuticals, LLC (US) 2013-02-05 US disclosed
US-20120196847-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors OSI Pharmaceuticals, LLC 2012-08-02 US disclosed
US-20120077979-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors OSI Pharmaceuticals, LLC 2012-03-29 US disclosed
US-8101613-B2 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI Pharmaceuticals, LLC (US) 2012-01-24 US disclosed
EP-2308879-A1 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI Pharmaceuticals, Inc. (US) 2011-04-13 EP disclosed
EP-2168968-A1 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI Pharmaceuticals, Inc. (US) 2010-03-31 EP disclosed
US-20090325928-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors OSI PHARMACEUTICALS, INC. 2009-12-31 US disclosed
EP-1740591-B1 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI PHARM INC (US) 2009-06-17 EP disclosed
US-7534797-B2 6,6-Bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI PHARMACEUTICALS, INC. (US) 2009-05-19 US disclosed
US-20060235031-A1 6,6-Bicyclic ring substituted heterobicyclic protein kinase inhibitors ACERTA PHARMA B.V. (NL) 2006-10-19 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 (4 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-20120077979-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors IGF1R, MAP2K7, BRCA1 IGF1R 1/4885INSR 27/4885KDR 1497/4885
US-20090325928-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors IGF1R, MAP2K7, BRCA1 IGF1R 1/4885INSR 27/4885KDR 1497/4885
US-20120196847-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors IGF1R, MAP2K7, BRCA1 IGF1R 1/4885INSR 27/4885KDR 1497/4885
US-20060235031-A1 6,6-Bicyclic ring substituted heterobicyclic protein kinase inhibitors IGF1R, MAP2K7, BRCA1 IGF1R 1/4885INSR 27/4885KDR 1497/4885

“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.