SCHEMBL1945829

SCHEMBL1945829

O=C(Nc1cc(-c2cccc(NCc3cccc(OC(F)F)c3)n2)c(Cl)cn1)[C@@H]1CCCNC1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 16/20 0.62
CDK9 P50750 6/20 0.56

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
SCHEMBL10285393 0.94 CDK9 (0.55) CCNT1CDK9
SCHEMBL1462932 0.89 CCNT1 (0.73) CCNT1CDK9
SCHEMBL1463044 0.89 CCNT1 (0.73) CCNT1CDK9
SCHEMBL1945896 0.89 CCNT1 (0.63) CCNT1CDK9
SCHEMBL10241765 0.87 CDK9 (0.56) CCNT1CDK9
SCHEMBL1947665 0.86 CCNT1 (0.73) CCNT1CDK9
SCHEMBL1947651 0.86 CCNT1 (0.64) CCNT1CDK9
SCHEMBL1947397 0.86 CCNT1 (0.61) CCNT1CDK9
SCHEMBL1946518 0.86 CCNT1 (0.72) CCNT1CDK9
SCHEMBL1949163 0.84 CCNT1 (0.67) CCNT1CDK9

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-20110130380-A1 Heteroaryl Kinase Inhibitors NOVARTIS AG (CH) 2011-06-02 US disclosed
US-20110130380-A1 Heteroaryl Kinase Inhibitors NOVARTIS AG (CH) 2011-06-02 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-20110130380-A1 Heteroaryl Kinase Inhibitors CDK2, CDK1, CDKL1 CCNT1 47/4885CDK9 5/4885

“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.