SCHEMBL9902839

SCHEMBL9902839

COc1ncc(Cl)cc1-c1cnc2ccc(Cl)nn12

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 11/20 0.59
DYRK2 Q92630 11/20 0.59
DYRK1B Q9Y463 10/20 0.59
CDK5 Q00535 9/20 0.59
CDK5R1 Q15078 9/20 0.59
DYRK3 O43781 9/20 0.59
CCNA2 P20248 7/20 0.59
CDK2 P24941 7/20 0.59
CCNT1 O60563 6/20 0.51
CDK9 P50750 6/20 0.51
MKNK1 Q9BUB5 2/20 0.43
FYN P06241 5/20 0.40
TNF P01375 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
SCHEMBL9902768 0.87 DYRK1A (0.50) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL9902267 0.82 DYRK1A (0.58) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL9903599 0.78 DYRK1A (0.48) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL9902779 0.77 ALK (0.43) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL16371015 0.74 DYRK1A (0.56) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL13234222 0.74 DYRK1A (0.58) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL13234221 0.73 FYN (0.68) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL3043884 0.72 FYN (0.67) DYRK1ADYRK2DYRK1BCDK5CDK5R1
SCHEMBL3513641 0.72 FYN (0.74) FYN
SCHEMBL13234223 0.72 FYN (0.61) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133200-B2 Imidazo[1,2-b]pyridazine and imidazo[4,5-b]pyridine derivatives as JAK inhibitors ALMIRALL, S.A. (ES) 2015-09-15 US disclosed
US-20130309200-A1 IMIDAZO [1,2-B] PYRIDAZINE AND IMIDAZO [4,5-B] PYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-11-21 US disclosed
EP-2463289-A1 Imidazo[1,2-b]pyridazine derivatives as JAK inhibitors Almirall, S.A. (ES) 2012-06-13 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 (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-20130309200-A1 IMIDAZO [1,2-B] PYRIDAZINE AND IMIDAZO [4,5-B] PYRIDINE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 DYRK1A 595/4885DYRK2 356/4885DYRK1B 503/4885

“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.