SCHEMBL16009352

SCHEMBL16009352

Clc1ccc2ncc(-c3cc4ccncc4s3)n2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 10/20 0.56
DYRK2 Q92630 9/20 0.56
DYRK1B Q9Y463 9/20 0.56
CDK5 Q00535 8/20 0.56
CDK5R1 Q15078 7/20 0.56
DYRK3 O43781 7/20 0.56
CCNA2 P20248 6/20 0.56
CDK2 P24941 6/20 0.56
CDK9 P50750 5/20 0.50
CCNT1 O60563 4/20 0.50
PIK3CD O00329 1/20 0.48
PIK3R1 P27986 1/20 0.48
MKNK1 Q9BUB5 1/20 0.45
FYN P06241 5/20 0.42
CYP2A6 P11509 1/20 0.40
CHEK1 O14757 1/20 0.39
AURKA O14965 1/20 0.39
DAPK3 O43293 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 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
SCHEMBL16009662 0.91 DYRK1A (0.55) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL13234229 0.86 MKNK1 (0.55) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16010281 0.80 DYRK1A (0.48) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16010250 0.80 DYRK1A (0.45) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16010452 0.79 DYRK1A (0.55) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16009727 0.79 DYRK1A (0.55) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16009421 0.78 FYN (0.46) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16010023 0.78 DYRK1A (0.48) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16010185 0.77 DYRK1A (0.45) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16009722 0.77 DYRK1A (0.47) DYRK1ADYRK2DYRK1BCDK5CDK5R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160228437-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. 2016-08-11 US disclosed
US-20160228437-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. 2016-08-11 US disclosed
US-20160228437-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. 2016-08-11 US disclosed
US-9370515-B2 Mixed lineage kinase inhibitors and method of treatments Califia Bio, Inc. (US) 2016-06-21 US disclosed
US-9370515-B2 Mixed lineage kinase inhibitors and method of treatments Califia Bio, Inc. (US) 2016-06-21 US disclosed
US-9370515-B2 Mixed lineage kinase inhibitors and method of treatments Califia Bio, Inc. (US) 2016-06-21 US disclosed
EP-2964230-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. (US) 2016-01-13 EP disclosed
WO-2014138692-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. (US) 2014-09-12 WO disclosed
WO-2014138692-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. (US) 2014-09-12 WO disclosed
US-20140256733-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. (US) 2014-09-11 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 (2 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-20160228437-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS MAP3K2, MAP3K1, MAP3K20 DYRK1A 442/4885DYRK2 402/4885DYRK1B 439/4885
US-20140256733-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS MAP3K2, MAP3K1, MAP3K20 DYRK1A 442/4885DYRK2 402/4885DYRK1B 439/4885

“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.