SCHEMBL1723802

SCHEMBL1723802

C1=C(c2ccnc3[nH]ccc23)CCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.55
JAK3 P52333 2/20 0.55
JAK1 P23458 1/20 0.55
IKBKB O14920 4/20 0.51
CHUK O15111 4/20 0.51
AURKB Q96GD4 3/20 0.51
IGF1R P08069 2/20 0.51
DYRK1B Q9Y463 2/20 0.51
DAPK3 O43293 1/20 0.51
PRKD3 O94806 1/20 0.51
MAP4K4 O95819 1/20 0.51
PAK4 O96013 1/20 0.51
CSF1R P07333 1/20 0.51
RET P07949 1/20 0.51
FGFR1 P11362 1/20 0.51
PRKACA P17612 1/20 0.51
FLT1 P17948 1/20 0.51
LTK P29376 1/20 0.51
GRK5 P34947 1/20 0.51
KDR P35968 1/20 0.51

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
SCHEMBL1723771 0.95 JAK2 (0.61) JAK2JAK3JAK1IKBKBCHUK
SCHEMBL10124857 0.79 CDK9 (0.49) JAK2JAK3IKBKBCHUKAURKB
SCHEMBL2240671 0.77 AURKB (0.71) JAK2JAK3IKBKBCHUKAURKB
SCHEMBL4062740 0.75 JAK3 (0.91) JAK2JAK3JAK1IKBKBCHUK
SCHEMBL4412860 0.73 DYRK1A (0.51) JAK2JAK3JAK1DAPK3MAP4K4
SCHEMBL1726149 0.72 JAK3 (0.51) JAK2JAK3JAK1KDRDYRK1A
SCHEMBL14493878 0.71 CCNT1 (0.50) JAK3JAK1AURKBMAP4K4FGFR1
SCHEMBL13961115 0.71 JAK3 (1.00) JAK2JAK3JAK1IKBKBCHUK
SCHEMBL12346363 0.71 AURKB (0.47) JAK2JAK3IKBKBCHUKAURKB
SCHEMBL27819451 0.70 HTR1A (0.46) JAK1AURKBCDK9NUDT1AURKA

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3070086-B1 AZAINDOLE DERIVATIVE TAIHO PHARMACEUTICAL CO LTD (JP) 2018-11-21 EP disclosed
US-9782392-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-10-10 US disclosed
US-9782392-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-10-10 US disclosed
US-9782392-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-10-10 US disclosed
US-9676773-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-06-13 US disclosed
US-9676773-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-06-13 US disclosed
US-9676773-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-06-13 US disclosed
US-20170119743-A1 AZAINDOLE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-05-04 US disclosed
US-20170119743-A1 AZAINDOLE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-05-04 US disclosed
US-20170119743-A1 AZAINDOLE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-05-04 US disclosed
US-8921376-B2 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-12-30 US disclosed
EP-1881983-B1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE VERTEX PHARMA (US) 2012-01-11 EP disclosed
EP-1881983-B1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE VERTEX PHARMA (US) 2012-01-11 EP disclosed
EP-2354139-A1 Pyrrolopyridines useful as inhibitors of protein kinase Vertex Pharmaceuticals Incorporated (US) 2011-08-10 EP disclosed
EP-2354140-A1 Pyrrolopyridines useful as inhibitors of protein kinase Vertex Pharmaceuticals Incorporated (US) 2011-08-10 EP disclosed
EP-1881983-A1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE Vertex Pharmaceuticals, Inc. (US) 2008-01-30 EP disclosed
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2007-06-14 US disclosed
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2007-06-14 US disclosed
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2007-06-14 US disclosed
WO-2006127587-A1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2006-11-30 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-20170119743-A1 AZAINDOLE DERIVATIVE JAK3, JAK1, JAK2 JAK2 3/4885JAK3 1/4885JAK1 2/4885
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase JAK2, JAK1, JAK3 JAK2 1/4885JAK3 3/4885JAK1 2/4885

“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.