SCHEMBL10242724

SCHEMBL10242724

CC(C)C(=O)Nc1cc(-c2cc(NCC3CCOCC3)ccc2Cl)c(Cl)cn1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 12/20 0.54
CDK9 P50750 7/20 0.54
CCNK O75909 3/20 0.48
CNR2 P34972 3/20 0.45
ABL1 P00519 1/20 0.44

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
SCHEMBL12565971 0.90 CCNT1 (0.67) CCNT1CDK9CCNK
SCHEMBL12812140 0.89 CCNT1 (0.51) CCNT1CDK9CCNKCNR2ABL1
SCHEMBL10242714 0.88 CDK9 (0.50) CCNT1CDK9CCNKCNR2
SCHEMBL10241724 0.87 CDK9 (0.61) CCNT1CDK9CCNKCNR2ABL1
SCHEMBL1948865 0.85 CCNT1 (0.66) CCNT1CDK9CCNK
SCHEMBL1463028 0.83 CCNT1 (0.67) CCNT1CDK9
SCHEMBL1945863 0.83 CCNT1 (0.52) CCNT1CDK9CCNKCNR2
SCHEMBL10285490 0.82 CCNT1 (0.53) CCNT1CDK9CCNK
SCHEMBL1439734 0.82 CCNT1 (0.69) CCNT1CDK9CCNK
SCHEMBL10242723 0.82 CDK9 (0.66) CCNT1CDK9ABL1

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 CCNT1 80/4885CDK9 6/4885CCNK 27/4885

“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.