SCHEMBL1284852

SCHEMBL1284852

O=C(NCCCNc1nc(Cl)ncc1Br)C1CCC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 19/20 0.61
PDPK1 O15530 3/20 0.61
STK17A Q9UEE5 3/20 0.55
MARK4 Q96L34 2/20 0.55
MARK3 P27448 2/20 0.55
IKBKE Q14164 4/20 0.48
AURKB Q96GD4 4/20 0.48
CDK2 P24941 3/20 0.48
BRSK2 Q8IWQ3 1/20 0.47
MKNK1 Q9BUB5 1/20 0.47
STK17B O94768 1/20 0.46

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
SCHEMBL22818572 0.88 STK17B (0.59) TBK1PDPK1STK17AMARK3IKBKE
SCHEMBL23331347 0.86 TBK1 (0.50) TBK1PDPK1STK17AMARK4MARK3
SCHEMBL22818574 0.86 ULK1 (0.52) TBK1PDPK1STK17AMARK3IKBKE
SCHEMBL15188869 0.86 TBK1 (0.50) TBK1PDPK1STK17AMARK3IKBKE
SCHEMBL13432001 0.85 TBK1 (0.68) TBK1PDPK1STK17AMARK4MARK3
SCHEMBL13431995 0.82 TBK1 (0.65) TBK1PDPK1STK17AMARK4MARK3
SCHEMBL1617905 0.82 TBK1 (0.47) TBK1PDPK1STK17AMARK4MARK3
SCHEMBL17162049 0.81 TBK1 (0.63) TBK1PDPK1STK17AMARK4MARK3
SCHEMBL29666237 0.81 TBK1 (0.63) TBK1PDPK1STK17AMARK4MARK3
SCHEMBL21501554 0.78 TBK1 (0.55) TBK1PDPK1STK17AMARK4MARK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230338376-A1 AMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-10-26 US disclosed
US-20230338376-A1 AMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-10-26 US disclosed
US-11590134-B2 Aminopyrimidine amide autophagy inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2023-02-28 US disclosed
US-20210128556-A1 AMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2021-05-06 US disclosed
WO-2020257180-A1 AMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC (US) 2020-12-24 WO disclosed
US-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-04-12 US disclosed
US-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-04-12 US disclosed
US-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-04-12 US disclosed
EP-2403853-A1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS Medical Research Council Technology (GB) 2012-01-11 EP 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-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MARK3, MAPK8, CDK8 TBK1 17/4885PDPK1 280/4885STK17A 64/4885
US-20210128556-A1 AMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 TBK1 260/4885PDPK1 148/4885STK17A 548/4885
US-11590134-B2 Aminopyrimidine amide autophagy inhibitors and methods of use thereof BECN1, SQSTM1, ATG7 TBK1 260/4885PDPK1 148/4885STK17A 548/4885
US-20230338376-A1 AMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 TBK1 260/4885PDPK1 148/4885STK17A 548/4885

“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.