SCHEMBL3618952

SCHEMBL3618952

NC(=O)c1cnc(N)c2c1[nH]c1c(Cl)cccc12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 9/20 0.48
CDK9 P50750 5/20 0.48
DYRK2 Q92630 3/20 0.48
DYRK1B Q9Y463 3/20 0.48
CLK1 P49759 1/20 0.48
CDK5 Q00535 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48
JAK2 O60674 3/20 0.46
MAP2 P11137 1/20 0.44
HAVCR2 Q8TDQ0 1/20 0.43
CHEK1 O14757 1/20 0.41
FLT3 P36888 1/20 0.41
PLK3 Q9H4B4 1/20 0.41
KDM4E B2RXH2 1/20 0.41
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40
MAP4K4 O95819 1/20 0.38

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
SCHEMBL3617529 0.80 JAK2 (0.59) DYRK1AJAK2JAK3
SCHEMBL29523335 0.80 JAK2 (0.59) DYRK1AJAK2JAK3
SCHEMBL3609540 0.75 JAK2 (0.62) JAK2JAK1JAK3
SCHEMBL3604228 0.75 HAVCR2 (0.44) CDK9JAK2HAVCR2CHEK1JAK1
SCHEMBL15090916 0.73 HAVCR2 (0.47) JAK2HAVCR2KDM4EJAK1TYK2
SCHEMBL3607833 0.71 JAK2 (0.59) DYRK1AJAK2JAK3
SCHEMBL3619485 0.70 JAK2 (0.52) JAK2JAK3
SCHEMBL3614269 0.70 JAK2 (0.71) JAK2JAK3MAP4K4
SCHEMBL18138214 0.69 DYRK1A (0.47) DYRK1AJAK2JAK1JAK3
SCHEMBL3610876 0.68 JAK2 (0.46) JAK2JAK1JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8518964-B2 Tricyclic compounds useful as inhibitors of kinases MERCK SHARP & DOHME CORP. (US) 2013-08-27 US claimed
EP-1954290-B1 TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES MERCK SHARP & DOHME (US) 2012-07-25 EP claimed
US-20100048551-A1 Tricyclic Compounds Useful as Inhibitors of Kinases MERCK SHARP & DOHME LLC 2010-02-25 US claimed
US-8518964-B2 Tricyclic compounds useful as inhibitors of kinases MERCK SHARP & DOHME CORP. (US) 2013-08-27 US disclosed
US-8518964-B2 Tricyclic compounds useful as inhibitors of kinases MERCK SHARP & DOHME CORP. (US) 2013-08-27 US disclosed
US-8518964-B2 Tricyclic compounds useful as inhibitors of kinases MERCK SHARP & DOHME CORP. (US) 2013-08-27 US disclosed
EP-1954290-B1 TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES MERCK SHARP & DOHME (US) 2012-07-25 EP disclosed
EP-1954290-B1 TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES MERCK SHARP & DOHME (US) 2012-07-25 EP disclosed
US-20100048551-A1 Tricyclic Compounds Useful as Inhibitors of Kinases MERCK SHARP & DOHME LLC 2010-02-25 US disclosed
US-20100048551-A1 Tricyclic Compounds Useful as Inhibitors of Kinases MERCK SHARP & DOHME LLC 2010-02-25 US disclosed
US-20100048551-A1 Tricyclic Compounds Useful as Inhibitors of Kinases MERCK SHARP & DOHME LLC 2010-02-25 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 (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-20100048551-A1 Tricyclic Compounds Useful as Inhibitors of Kinases JAK2, JAK3, JAK1 DYRK1A 370/4885CDK9 122/4885DYRK2 353/4885

“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.