SCHEMBL10242758

SCHEMBL10242758

CC1(C)CO[C@H](CNc2cccc(-c3cc(NC(=O)[C@@H]4CCCNC4)ncc3Cl)c2)CO1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 20/20 0.53

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
SCHEMBL10242757 1.00 CDK9 (0.53) CDK9
SCHEMBL10242083 0.89 CDK9 (0.52) CDK9
SCHEMBL10242082 0.89 CDK9 (0.52) CDK9
SCHEMBL10242887 0.88 CDK9 (0.54) CDK9
SCHEMBL10242736 0.88 CDK9 (0.55) CDK9
SCHEMBL10241709 0.88 CDK9 (0.55) CDK9
SCHEMBL10242880 0.87 CDK9 (0.57) CDK9
SCHEMBL1947182 0.87 CCNT1 (0.55) CDK9
SCHEMBL1946151 0.87 CCNT1 (0.55) CDK9
SCHEMBL1946420 0.87 CCNT1 (0.55) CDK9

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 1 patent. 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

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 CDK9 6/4885

“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.