SCHEMBL6115453

SCHEMBL6115453

COc1ccc(-c2cncc3[nH]nc(N)c23)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 5/20 0.74
KDR P35968 8/20 0.50
LCK P06239 4/20 0.50
CSF1R P07333 4/20 0.50
KIT P10721 3/20 0.50
FLT3 P36888 3/20 0.50
LYN P07948 3/20 0.50
SRC P12931 3/20 0.50
FLT1 P17948 3/20 0.50
BLK P51451 3/20 0.50
ABL1 P00519 3/20 0.50
FYN P06241 2/20 0.50
FLT4 P35916 2/20 0.50
MAPT P10636 1/20 0.50
ACHE P22303 1/20 0.45
KMT2A Q03164 1/20 0.44
FGFR1 P11362 2/20 0.43
PRKACA P17612 2/20 0.43
ROCK1 Q13464 2/20 0.43
DYRK1A Q13627 2/20 0.43

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
SCHEMBL1162998 0.96 BTK (0.69) BTKKDRLCKCSF1RKIT
SCHEMBL6115998 0.88 BTK (0.62) BTKKDRLCKCSF1RKIT
SCHEMBL6115976 0.87 BTK (0.61) BTKKDRLCKCSF1RKIT
SCHEMBL6115796 0.85 BTK (1.00) BTKKDRLCKCSF1RKIT
SCHEMBL6116012 0.84 BTK (0.57) BTKKDRLCKCSF1RKIT
SCHEMBL6115425 0.83 BTK (0.67) BTKKDRLCKCSF1RKIT
SCHEMBL1703256 0.83 BTK (0.67) BTKKDRLCKCSF1RKIT
SCHEMBL6116093 0.82 BTK (0.65) BTKKDRLCKCSF1RKIT
SCHEMBL6116187 0.82 BTK (0.65) BTKKDRLCKCSF1RKIT
SCHEMBL8401681 0.82 BTK (0.77) BTKKDRLCKCSF1RKIT

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
EP-2789615-B1 Azaindazoles as Btk kinase modulators and use thereof BRISTOL MYERS SQUIBB CO (US) 2017-05-03 EP claimed
US-8846673-B2 Azaindazoles as kinase inhibitors and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-30 US claimed
EP-2789615-B1 Azaindazoles as Btk kinase modulators and use thereof BRISTOL MYERS SQUIBB CO (US) 2017-05-03 EP disclosed
EP-2789615-B1 Azaindazoles as Btk kinase modulators and use thereof BRISTOL MYERS SQUIBB CO (US) 2017-05-03 EP disclosed
EP-2789615-A1 Azaindazoles as Btk kinase modulators and use thereof Bristol-Myers Squibb Company (US) 2014-10-15 EP disclosed
EP-2789615-A1 Azaindazoles as Btk kinase modulators and use thereof Bristol-Myers Squibb Company (US) 2014-10-15 EP disclosed
US-8846673-B2 Azaindazoles as kinase inhibitors and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-30 US disclosed
US-8846673-B2 Azaindazoles as kinase inhibitors and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-30 US disclosed
US-8846673-B2 Azaindazoles as kinase inhibitors and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-30 US disclosed
US-20120129852-A1 AZAINDAZOLES AS KINASE INHIBITORS AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2012-05-24 US disclosed
US-20120129852-A1 AZAINDAZOLES AS KINASE INHIBITORS AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2012-05-24 US disclosed
US-20120129852-A1 AZAINDAZOLES AS KINASE INHIBITORS AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2012-05-24 US disclosed
WO-2011019780-A1 AZAINDAZOLES AS BTK KINASE MODULATORS AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2011-02-17 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 (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-20120129852-A1 AZAINDAZOLES AS KINASE INHIBITORS AND USE THEREOF BTK, ABL1, JAK1 BTK 1/4885KDR 476/4885LCK 4/4885

“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.