SCHEMBL22191848

SCHEMBL22191848

NC(=O)c1cccc(CNc2cncc(-c3ccc4[nH]c(=O)[nH]c4c3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.49
▸ CDK7 P50613 10/20 0.44
▸ VNN1 O95497 1/20 0.42
▸ CDK2 P24941 7/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ CLK1 P49759 1/20 0.41
▸ FYN P06241 1/20 0.41
▸ CYP11B2 P19099 1/20 0.40
▸ BCL6 P41182 1/20 0.40
▸ BCOR Q6W2J9 1/20 0.40
▸ AURKA O14965 1/20 0.39
▸ RPS6KB1 P23443 1/20 0.39
▸ AURKB Q96GD4 1/20 0.39

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
SCHEMBL22191669 0.89 DYRK1A (0.46) DYRK1ACDK7KDM4EGAAMKNK1
SCHEMBL22191607 0.85 FYN (0.54) CDK7CDK2KDM4EGAAFYN
SCHEMBL22191078 0.84 VNN1 (0.54) DYRK1ACDK7VNN1CDK2MKNK1
SCHEMBL22191227 0.84 PDE3B (0.47) CDK7CDK2KDM4EGAAMKNK2
SCHEMBL22191602 0.83 GAA (0.48) DYRK1AKDM4EGAAFYN
SCHEMBL22191838 0.83 CCNT1 (0.48) DYRK1ACDK2KDM4EGAACLK1
SCHEMBL4190030 0.82 FYN (0.60) DYRK1ACDK7VNN1CDK2MKNK1
SCHEMBL29664810 0.82 GAA (0.45) CDK7CDK2KDM4EGAAMKNK1
SCHEMBL22191151 0.81 BCL6 (0.48) DYRK1ACDK2KDM4ECLK1BCL6
SCHEMBL22191218 0.80 GAA (0.52) DYRK1AKDM4EGAACLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3906233-B1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL MED MOUNT SINAI (US) 2024-01-31 — — EP disclosed
US-20220162182-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-05-26 — — US disclosed
US-20220162182-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-05-26 — — US disclosed
EP-3906233-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE Icahn School of Medicine at Mount Sinai (US) 2021-11-10 — — EP disclosed
CN-113508111-A Kinase inhibitor compounds and compositions and methods of use 西奈山伊坎医学院 2021-10-15 — — CN disclosed
WO-2020142485-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2020-07-09 — — 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-20220162182-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE MAP3K20, MAP3K1, PACSIN2 DYRK1A 481/4885CDK7 120/4885VNN1 4453/4885

“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.

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