SCHEMBL8940317

SCHEMBL8940317

Fc1cnc2[nH]cc(-c3cccc(NCc4ccccc4)n3)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.50
CDK2 P24941 3/20 0.50
PLK4 O00444 2/20 0.50
CHEK1 O14757 2/20 0.50
JAK2 O60674 2/20 0.50
ROCK2 O75116 2/20 0.50
EGFR P00533 2/20 0.50
CSF1R P07333 2/20 0.50
RET P07949 2/20 0.50
PIM1 P11309 2/20 0.50
FGFR1 P11362 2/20 0.50
PRKACA P17612 2/20 0.50
TYK2 P29597 2/20 0.50
AKT1 P31749 2/20 0.50
KDR P35968 2/20 0.50
FLT3 P36888 2/20 0.50
GSK3B P49841 2/20 0.50
JAK3 P52333 2/20 0.50
PTK6 Q13882 2/20 0.50
PIM3 Q86V86 2/20 0.50

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
SCHEMBL8940238 0.87 JAK2 (0.55) CDC7CDK2PLK4CHEK1JAK2
SCHEMBL8940442 0.87 CDC7 (0.50) CDC7CDK2PLK4CHEK1JAK2
SCHEMBL8942080 0.87 AXL (0.57) CDC7CDK2PLK4CHEK1JAK2
SCHEMBL13918318 0.83 MAP3K14 (0.48) CDC7CDK2PLK4CHEK1JAK2
SCHEMBL8941978 0.80 SGK1 (0.54) CDC7CDK2KITCCNT1CDK9
SCHEMBL1666746 0.80 CCNT1 (0.49) CDC7CDK2PLK4CHEK1JAK2
SCHEMBL8941974 0.78 JAK2 (0.46) CDC7CDK2JAK2ROCK2CSF1R
SCHEMBL8941999 0.77 SGK1 (0.53) CDK2CLK4CCNT1DYRK1ACDK9
SCHEMBL12657773 0.76 CCNT1 (0.48) CDC7CDK2PLK4CHEK1JAK2
SCHEMBL8941967 0.76 JAK2 (0.53) CDK2PLK4CHEK1JAK2ROCK2

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-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-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-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 (3 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 CDC7 274/4885CDK2 23/4885PLK4 725/4885
US-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases JAK3, JAK2, JAK1 CDC7 274/4885CDK2 23/4885PLK4 725/4885
US-20150152103-A1 AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES JAK3, JAK2, JAK1 CDC7 274/4885CDK2 23/4885PLK4 725/4885

“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.