SCHEMBL10242064

SCHEMBL10242064

CC(=O)N1CCC[C@H](C(=O)Nc2cc(-c3cccc(NCC4CCOCC4)c3)c(Cl)cn2)C1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.51
MAPK10 P53779 1/20 0.51
MAPK14 Q16539 1/20 0.51
CDK9 P50750 17/20 0.49
CCNT1 O60563 3/20 0.48

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
SCHEMBL10242065 0.93 CDK9 (0.50) CDK9CCNT1
SCHEMBL10242964 0.90 CDK9 (0.50) CDK9CCNT1
SCHEMBL10244032 0.90 CDK9 (0.50) CDK9CCNT1
SCHEMBL10242891 0.89 CDK9 (0.50) CDK9CCNT1
SCHEMBL10242740 0.89 CDK9 (0.50) CDK9CCNT1
SCHEMBL10242056 0.89 CDK9 (0.55) CDK9CCNT1
SCHEMBL10242052 0.88 CDK9 (0.57) CDK9CCNT1
SCHEMBL10241723 0.88 CDK9 (0.55) CDK9CCNT1
SCHEMBL10242895 0.87 CDK9 (0.54) CDK9CCNT1
SCHEMBL10242899 0.87 CDK9 (0.54) CDK9CCNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157433-A1 Heteroaryl Compounds as Kinase Inhibitors PFISTER KEITH B (US) 2012-06-21 US disclosed
WO-2011026917-A1 HETEROARYL COMPOUNDS AS KINASE INHIBITORS NOVARTIS AG (CH) 2011-03-10 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-20120157433-A1 Heteroaryl Compounds as Kinase Inhibitors CDK2, CDK1, CDK6 MAPK8 138/4885MAPK10 130/4885MAPK14 162/4885

“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.