SCHEMBL13306147

SCHEMBL13306147

CC(C)c1nn(-c2c(Cl)cncc2Cl)c(N)c1C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.45
KDR P35968 3/20 0.45
GABRP O00591 3/20 0.36
GABRD O14764 3/20 0.36
GABRA1 P14867 3/20 0.36
GABRB1 P18505 3/20 0.36
GABRG2 P18507 3/20 0.36
GABRB3 P28472 3/20 0.36
GABRA5 P31644 3/20 0.36
GABRA3 P34903 3/20 0.36
GABRA2 P47869 3/20 0.36
GABRB2 P47870 3/20 0.36
GABRA4 P48169 3/20 0.36
GABRE P78334 3/20 0.36
GABRA6 Q16445 3/20 0.36
GABRG1 Q8N1C3 3/20 0.36
GABRG3 Q99928 3/20 0.36
GABRQ Q9UN88 3/20 0.36
CYP3A4 P08684 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL1180138 0.86 SRC (0.45) SRCKDRGABRPGABRDGABRA1
SCHEMBL6208048 0.86 KDR (0.57) SRCKDRGABRPGABRDGABRA1
SCHEMBL6402245 0.80 EPHB4 (0.50) SRCKDRRIPK2PLK4ROCK2
SCHEMBL2349535 0.77 SRC (0.40) SRCKDRL3MBTL1RIPK2RET
SCHEMBL13330183 0.74 GABRP (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13306144 0.74
SCHEMBL20334823 0.70 RET (0.38) SRCKDRCYP3A4RIPK2RET
SCHEMBL20334789 0.68 RET (0.52) SRCCYP3A4RET
SCHEMBL12449760 0.67 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1703067 0.66 ICAM1 (0.47) CYP3A4MAP4K4MKNK2ICAM1SELE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130035349-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR AGENNIX AG (DE) 2013-02-07 US disclosed
US-20130035349-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR AGENNIX AG (DE) 2013-02-07 US disclosed
US-8304418-B2 Pyrazolopyrimidinone kinase inhibitor AGENNIX AG (DE) 2012-11-06 US disclosed
US-8304418-B2 Pyrazolopyrimidinone kinase inhibitor AGENNIX AG (DE) 2012-11-06 US disclosed
US-20100160350-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR AGENNIX AG (DE) 2010-06-24 US disclosed
US-20100160350-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR AGENNIX AG (DE) 2010-06-24 US disclosed
EP-2019101-A1 Pyrazol[3,4-d]pyrimidin-4-one useful as Kinase Inhibitor GPC Biotech AG (DE) 2009-01-28 EP disclosed
WO-2008145678-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR GPC BIOTECH AG (DE) 2008-12-04 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-20130035349-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR MAP3K19, MAP3K4, MAP3K1 SRC 360/4885KDR 1079/4885GABRP 2615/4885
US-20100160350-A1 PYRAZOLOPYRIMIDINONE KINASE INHIBITOR MAP3K19, MAP3K4, MAP3K1 SRC 360/4885KDR 1079/4885GABRP 2615/4885

“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.