SCHEMBL3538523

SCHEMBL3538523

CCOc1cc(C(=O)N[C@@H]2CCN(C)C2)c(F)cc1Nc1ncc2c(n1)N(C(C)C)CC(C)(C)C(=O)N2C

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 20/20 0.63
PLK3 Q9H4B4 7/20 0.60
PLK2 Q9NYY3 7/20 0.60
BRD4 O60885 2/20 0.49
BRDT Q58F21 1/20 0.49

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
SCHEMBL3547126 0.96 PLK1 (0.67) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3543832 0.95 PLK1 (0.68) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3547749 0.89 PLK1 (0.61) PLK1PLK3PLK2BRD4BRDT
SCHEMBL1675947 0.87 PLK1 (0.80) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3543790 0.85 PLK1 (0.66) PLK1PLK3PLK2BRD4
SCHEMBL3540805 0.85 PLK1 (0.60) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3546555 0.84 PLK1 (0.83) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3811711 0.83 PLK1 (0.74) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3547694 0.83 PLK1 (0.66) PLK1PLK3BRD4BRDT
SCHEMBL3541137 0.82 PLK1 (0.56) PLK1PLK3PLK2BRD4BRDT

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-7709471-B2 Compounds ASTRAZENECA AB (SE) 2010-05-04 US disclosed
US-20080009482-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 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-20080009482-A1 NOVEL COMPOUNDS CYP11B2, CYP11B1, CYP46A1 PLK1 847/4885PLK3 2136/4885PLK2 1286/4885

“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.