SCHEMBL8941891

SCHEMBL8941891

CS(=O)(=O)Nc1ccc(-c2cnc3[nH]cc(-c4ccc(C(N)=O)cc4)c3c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.77
CLK1 P49759 3/20 0.77
DYRK2 Q92630 3/20 0.77
DYRK1B Q9Y463 3/20 0.77
CAMKK2 Q96RR4 6/20 0.68
MAP3K11 Q16584 5/20 0.66
TNIK Q9UKE5 2/20 0.60
NTRK1 P04629 2/20 0.59
INSR P06213 2/20 0.59
MAPK8 P45983 2/20 0.59
CHUK O15111 1/20 0.59
AXL P30530 3/20 0.58
SGK1 O00141 3/20 0.58
CDC7 O00311 1/20 0.58
PLK4 O00444 1/20 0.58
CHEK1 O14757 1/20 0.58
AURKA O14965 1/20 0.58
MAPK13 O15264 1/20 0.58
PDPK1 O15530 1/20 0.58
DYRK3 O43781 1/20 0.58

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
SCHEMBL3773952 0.90 CLK1 (0.78) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL8941800 0.85 CLK1 (0.81) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL3768166 0.84 CLK1 (0.74) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL3772897 0.84 CLK1 (0.68) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL3771011 0.83 CLK1 (0.74) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL12572915 0.83 AXL (0.82) DYRK1ACAMKK2MAP3K11TNIKNTRK1
SCHEMBL8942073 0.83 CAMKK2 (0.68) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL3771492 0.82 TNIK (0.77) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL8941961 0.82 MAP3K11 (0.74) DYRK1ACLK1DYRK2DYRK1BCAMKK2
SCHEMBL3763937 0.82 CLK1 (0.71) DYRK1ACLK1DYRK2DYRK1BCAMKK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150152103-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED 2015-06-04 US disclosed
US-8987454-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-03-24 US disclosed
US-8987454-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-03-24 US disclosed
US-20140249138-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-09-04 US disclosed
US-20140249138-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-09-04 US disclosed
US-8722889-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-05-13 US disclosed
US-8722889-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-05-13 US disclosed
US-8501446-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-08-06 US disclosed
US-20120258958-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-10-11 US disclosed
US-8188281-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-8188281-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2009-07-09 US disclosed
US-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2009-07-09 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 (4 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-20120258958-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES JAK3, JAK2, JAK1 DYRK1A 461/4885CLK1 894/4885DYRK2 336/4885
US-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases JAK3, JAK2, JAK1 DYRK1A 461/4885CLK1 894/4885DYRK2 336/4885
US-20150152103-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES JAK3, JAK2, JAK1 DYRK1A 461/4885CLK1 894/4885DYRK2 336/4885
US-20140249138-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES JAK3, JAK2, JAK1 DYRK1A 461/4885CLK1 894/4885DYRK2 336/4885

“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.