SCHEMBL3010376

SCHEMBL3010376

COc1nc(Nc2cc(C3CC3)[nH]n2)nc(N2C[C@@H](OC)C[C@H]2C(=O)Nc2cnccn2)n1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 17/20 0.55
CDK2 P24941 4/20 0.41
CCNE2 O96020 3/20 0.41
CCNE1 P24864 3/20 0.41
HPGDS O60760 1/20 0.39
SRC P12931 1/20 0.38
CCNA2 P20248 1/20 0.37
CCNA1 P78396 1/20 0.37

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
SCHEMBL3004263 0.95 IGF1R (0.58) IGF1RCDK2CCNE2CCNE1HPGDS
SCHEMBL3013881 0.89 IGF1R (0.54) IGF1RCDK2CCNE2CCNE1SRC
SCHEMBL3013381 0.89 IGF1R (0.58) IGF1RCDK2CCNE2CCNE1
SCHEMBL13226221 0.89 IGF1R (0.51) IGF1RCDK2CCNE2CCNE1
SCHEMBL3009241 0.89 IGF1R (0.53) IGF1RCDK2CCNE2CCNE1HPGDS
SCHEMBL3005974 0.89 IGF1R (0.53) IGF1RCDK2CCNE2CCNE1HPGDS
SCHEMBL3013423 0.89 IGF1R (0.53) IGF1RCDK2CCNE2CCNE1HPGDS
SCHEMBL3011992 0.88 IGF1R (0.51) IGF1RCDK2CCNE2CCNE1HPGDS
SCHEMBL3011423 0.88 IGF1R (0.52) IGF1RCDK2CCNE2CCNE1HPGDS
SCHEMBL3013720 0.88 IGF1R (0.52) IGF1RCDK2CCNE2CCNE1HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8415340-B2 Triazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-09 US disclosed
US-8415340-B2 Triazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-09 US disclosed
US-8415340-B2 Triazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-09 US disclosed
EP-2175933-B1 TRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-08-22 EP disclosed
US-20100197654-A1 TRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-08-05 US disclosed
US-20100197654-A1 TRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-08-05 US disclosed
WO-2009015254-A1 TRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-29 WO 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-20100197654-A1 TRIAZINE KINASE INHIBITORS ABL1, STK25, FLT3 IGF1R 688/4885CDK2 108/4885CCNE2 1197/4885

“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.