SCHEMBL16371015

SCHEMBL16371015

COc1cc(N)ccc1-c1cnc2ccc(Cl)nn12

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 8/20 0.56
DYRK2 Q92630 8/20 0.56
CDK5 Q00535 7/20 0.56
CDK5R1 Q15078 7/20 0.56
DYRK1B Q9Y463 7/20 0.56
DYRK3 O43781 6/20 0.56
CCNA2 P20248 6/20 0.56
CDK2 P24941 6/20 0.56
CCNT1 O60563 4/20 0.56
CDK9 P50750 4/20 0.56
FYN P06241 10/20 0.44
MKNK1 Q9BUB5 1/20 0.42
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41

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
SCHEMBL136464 0.80 DYRK1A (0.51) DYRK1ADYRK2CDK5CDK5R1DYRK1B
SCHEMBL16371211 0.80 DYRK1A (0.48) DYRK1ADYRK2CDK5CDK5R1DYRK1B
SCHEMBL3513641 0.75 FYN (0.74) FYN
SCHEMBL13234223 0.75 FYN (0.61) DYRK1ADYRK2CDK5CDK5R1DYRK1B
SCHEMBL103153 0.75 DYRK1A (0.60) DYRK1ADYRK2CDK5CDK5R1DYRK1B
SCHEMBL16388818 0.75 AAK1 (0.62)
SCHEMBL17783093 0.75 AAK1 (0.62)
SCHEMBL9902839 0.74 DYRK1A (0.59) DYRK1ADYRK2CDK5CDK5R1DYRK1B
SCHEMBL24885918 0.73 DYRK1A (0.54) DYRK1ADYRK2CDK5CDK5R1DYRK1B
SCHEMBL102386 0.73 DYRK1A (0.51) DYRK1ADYRK2CDK5CDK5R1DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10253027-B2 Aryl lactam kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-09 US disclosed
US-20160152621-A1 ARYL LACTAM KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-06-02 US disclosed
EP-3019475-A1 ARYL AMIDE KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2016-05-18 EP disclosed
WO-2015006100-A1 ARYL AMIDE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-01-15 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 (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-20160152621-A1 ARYL LACTAM KINASE INHIBITORS AAK1, ADCK1, ANKK1 DYRK1A 449/4885DYRK2 412/4885CDK5 829/4885
US-10253027-B2 Aryl lactam kinase inhibitors AAK1, ADCK1, ANKK1 DYRK1A 449/4885DYRK2 412/4885CDK5 829/4885

“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.