SCHEMBL10167384

SCHEMBL10167384

Cc1ccc(Nc2ncc3cnn(-c4ccccc4)c3n2)cc1S(N)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.49
CDK1 P06493 5/20 0.49
SRC P12931 5/20 0.49
GSK3A P49840 5/20 0.49
GSK3B P49841 5/20 0.49
AURKA O14965 5/20 0.49
JAK2 O60674 4/20 0.49
MAP4K4 O95819 4/20 0.49
LCK P06239 4/20 0.49
FYN P06241 4/20 0.49
LYN P07948 4/20 0.49
RET P07949 4/20 0.49
ROS1 P08922 4/20 0.49
FGFR1 P11362 4/20 0.49
MARK3 P27448 4/20 0.49
TYK2 P29597 4/20 0.49
FLT4 P35916 4/20 0.49
FRK P42685 4/20 0.49
SYK P43405 4/20 0.49
MAPK9 P45984 4/20 0.49

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
SCHEMBL342867 0.98 GSK3A (0.48) KDRCDK1SRCGSK3AGSK3B
SCHEMBL10167385 0.78 BTK (0.45) KDRCDK1SRCGSK3AGSK3B
SCHEMBL342357 0.77 AURKA (0.52) CDK1AURKAAURKBBTKCCNB1
SCHEMBL10167410 0.77 AURKA (0.52) CDK1AURKAAURKBBTKCCNB1
SCHEMBL10167393 0.77 EGFR (0.45) KDRCDK1SRCGSK3AGSK3B
SCHEMBL343811 0.76 AURKA (0.51) CDK1AURKAJAK2FGFR1AURKB
SCHEMBL15428704 0.75 CDK1 (0.48) KDRCDK1SRCGSK3AGSK3B
SCHEMBL15428705 0.75 CDK1 (0.48) KDRCDK1SRCGSK3AGSK3B
SCHEMBL343868 0.74 CDK1 (0.41) KDRCDK1SRCGSK3AGSK3B
SCHEMBL343043 0.74 MERTK (0.42) KDRCDK1SRCGSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637529-B2 Pyrazolo[3,4-d]pyrimidine compounds AbbYie Inc. (US) 2014-01-28 US disclosed
US-8637529-B2 Pyrazolo[3,4-d]pyrimidine compounds AbbYie Inc. (US) 2014-01-28 US disclosed
US-20120015963-A1 NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-01-19 US disclosed
US-20120015963-A1 NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-01-19 US disclosed
WO-2011156698-A2 NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2011-12-15 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-20120015963-A1 NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS CHUK, MAP2K2, CDK3 KDR 3351/4885CDK1 10/4885SRC 1704/4885

“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.