SCHEMBL12972265

SCHEMBL12972265

CN1CCN(Cc2ccc(NC(=O)N3CCCCc4cc(Oc5cc(Cl)nc(N)n5)ccc43)cc2C(F)(F)F)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 2/20 0.58
CDK8 P49336 2/20 0.58
CDK1 P06493 1/20 0.58
ABL1 P00519 6/20 0.51
SRC P12931 6/20 0.51
KDR P35968 3/20 0.46
FGFR1 P11362 2/20 0.46
RET P07949 2/20 0.46
FGFR4 P22455 5/20 0.45
EGFR P00533 2/20 0.45
BRAF P15056 2/20 0.45
KIT P10721 3/20 0.44
MKNK1 Q9BUB5 3/20 0.43
MKNK2 Q9HBH9 3/20 0.43
BCR P11274 2/20 0.43
STK25 O00506 1/20 0.43
CIT O14578 1/20 0.43
MAP2K7 O14733 1/20 0.43
IKBKB O14920 1/20 0.43
AURKA O14965 1/20 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
SCHEMBL12972266 0.90 CDK8 (0.73) CDK2CDK8CDK1ABL1SRC
SCHEMBL12972326 0.88 CDK8 (0.74) CDK2CDK8CDK1ABL1SRC
SCHEMBL2777199 0.83 SRC (0.54) CDK2CDK8CDK1ABL1SRC
SCHEMBL2779602 0.83 CDK8 (0.63) CDK2CDK8CDK1ABL1SRC
SCHEMBL12972418 0.81 KDR (0.52) CDK8KDRRAF1
SCHEMBL12972249 0.81 KDR (0.58) CDK8KDRRETBRAFKIT
SCHEMBL12972316 0.81 HCK (0.53) CDK2CDK8CDK1ABL1SRC
SCHEMBL12972324 0.81 CDK8 (0.62) CDK2CDK8CDK1ABL1SRC
SCHEMBL2777686 0.80 SRC (0.52) CDK2CDK8CDK1ABL1SRC
SCHEMBL1324413 0.79 CDK1 (0.58) CDK2CDK8CDK1ABL1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855215-B2 Cyclic diaryl ureas suitable as tyrosine kinase inhibitors NOVARTIS AG (CH) 2010-12-21 US disclosed
US-7855215-B2 Cyclic diaryl ureas suitable as tyrosine kinase inhibitors NOVARTIS AG (CH) 2010-12-21 US disclosed
US-20080039440-A1 Cyclic Diaryl Ureas Suitable as Tyrosine Kinase Inhibitors BOLD GUIDO 2008-02-14 US disclosed
US-20080039440-A1 Cyclic Diaryl Ureas Suitable as Tyrosine Kinase Inhibitors BOLD GUIDO 2008-02-14 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-20080039440-A1 Cyclic Diaryl Ureas Suitable as Tyrosine Kinase Inhibitors RET, ROS1, BRAF CDK2 17/4885CDK8 173/4885CDK1 26/4885

“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.