SCHEMBL3763941

SCHEMBL3763941

CS(=O)(=O)c1cccc(Nc2nccc(-c3c(-c4ccc5nc(Cc6ccccc6)[nH]c5c4)nc4ccccn34)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.51
CDK19 Q9BWU1 2/20 0.49
ALK Q9UM73 2/20 0.49
IGF1R P08069 9/20 0.46
CDK2 P24941 3/20 0.46
CDK4 P11802 2/20 0.46
CCNE1 P24864 1/20 0.46
INSR P06213 2/20 0.42
AURKA O14965 1/20 0.42
MAP4K4 O95819 1/20 0.42
ABL1 P00519 1/20 0.42
LCK P06239 1/20 0.42
MET P08581 1/20 0.42
PDGFRB P09619 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
FLT3 P36888 1/20 0.42
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42

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
SCHEMBL3721467 0.93 CDK2 (0.51) BRAFCDK19ALKIGF1RCDK2
SCHEMBL3766246 0.93 CDK19 (0.51) BRAFCDK19ALKIGF1RCDK2
SCHEMBL3719614 0.87 IGF1R (0.44) BRAFCDK19ALKIGF1RINSR
SCHEMBL3763927 0.86 CDK19 (0.68) BRAFCDK19ALKIGF1RCDK2
SCHEMBL3766393 0.85 CDK19 (0.52) BRAFCDK19ALKIGF1RINSR
SCHEMBL3769673 0.84 CDK2 (0.54) BRAFCDK19ALKIGF1RCDK2
SCHEMBL3761148 0.83 CDK19 (0.44) BRAFCDK19ALKIGF1RCDK2
SCHEMBL3762706 0.82 CDK19 (0.63) BRAFCDK19ALKIGF1RCDK2
SCHEMBL3719496 0.81 IGF1R (0.46) CDK19ALKIGF1RCDK2CDK4
SCHEMBL3769630 0.81 CDK19 (0.68) BRAFCDK19ALKIGF1RCDK2

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
EP-2435435-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-01-29 EP claimed
US-8536180-B2 Pyrimidine inhibitors of kinase activity ABBVIE INC. (US) 2013-09-17 US claimed
WO-2010138575-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO claimed
US-20100305118-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 US claimed
EP-2435435-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-01-29 EP disclosed
US-8536180-B2 Pyrimidine inhibitors of kinase activity ABBVIE INC. (US) 2013-09-17 US disclosed
WO-2010138575-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 WO disclosed
US-20100305118-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 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 (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-20100305118-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY IGF1R, TK1, CDK2 BRAF 295/4885CDK19 69/4885ALK 701/4885

“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.