SCHEMBL3005683

SCHEMBL3005683

CO[C@H]1C[C@@H](C(=O)Nc2cnccn2)N(c2nc(Nc3cc(C4CC4)n[nH]3)nc(N3CCN(C(C)=O)CC3)n2)C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 8/20 0.41
KARS1 Q15046 1/20 0.37
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
CDK2 P24941 2/20 0.35
DYRK1B Q9Y463 2/20 0.35
MAP3K12 Q12852 6/20 0.34
ALK Q9UM73 1/20 0.33
PORCN Q9H237 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL3016658 0.95 IGF1R (0.42) IGF1RKARS1CDK5CDK5R1CDK2
SCHEMBL3014235 0.93 IGF1R (0.43) IGF1RKARS1CDK5CDK5R1CDK2
SCHEMBL3005768 0.93 IGF1R (0.42) IGF1RKARS1CDK5CDK5R1MAPT
SCHEMBL3008575 0.93 IGF1R (0.42) IGF1RKARS1CDK5CDK5R1CDK2
SCHEMBL3006348 0.93 IGF1R (0.42) IGF1RCDK5CDK5R1CDK2MAP3K12
SCHEMBL3000120 0.92 IGF1R (0.42) IGF1RKARS1CDK5CDK5R1
SCHEMBL3009598 0.91 IGF1R (0.41) IGF1RMAP3K12
SCHEMBL3019559 0.91 IGF1R (0.41) IGF1RCDK5CDK5R1CDK2ALK
SCHEMBL3011915 0.91 IGF1R (0.40) IGF1RCDK5CDK5R1ALK
SCHEMBL2999829 0.91 IGF1R (0.40) IGF1RCDK5CDK5R1CDK2ALK

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
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
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 688/4885KARS1 683/4885CDK5 214/4885

“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.