SCHEMBL6574780

SCHEMBL6574780

CCn1cnc2c(Nc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)nc(NC3CCC(O)CC3)nc21

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 10/20 0.69
PDE5A O76074 3/20 0.55
SRC P12931 1/20 0.54
PDGFRA P16234 6/20 0.51
CCNE1 P24864 6/20 0.51
CDK2 P24941 6/20 0.51
PRKCA P17252 1/20 0.50

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
SCHEMBL6574778 1.00 CDK1 (0.69) CDK1PDE5ASRCPDGFRACCNE1
SCHEMBL6574896 0.94 CDK1 (0.71) CDK1SRCPDGFRACCNE1CDK2
SCHEMBL6574816 0.94 CDK1 (0.71) CDK1SRCPDGFRACCNE1CDK2
SCHEMBL6576961 0.93 CDK1 (0.70) CDK1SRCPDGFRACCNE1CDK2
SCHEMBL6576959 0.93 CDK1 (0.70) CDK1SRCPDGFRACCNE1CDK2
SCHEMBL6574762 0.93 CDK1 (0.70) CDK1SRCPDGFRACCNE1CDK2
SCHEMBL6574758 0.93 CDK1 (0.70) CDK1SRCPDGFRACCNE1CDK2
SCHEMBL6574755 0.91 CDK1 (0.68) CDK1SRC
SCHEMBL6574759 0.91 CDK1 (0.68) CDK1SRC
SCHEMBL6576940 0.90 CDK1 (0.64) CDK1SRCPDGFRACCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153024-B1 2-AMINO-6-ANILINO-PURINES AND THEIR USE AS MEDICAMENTS NOVARTIS AG (CH) 2004-04-28 EP claimed
US-20020016329-A1 2-Amino-6-anilino-purines and their use as medicaments NOVARTIS AG (CH) 2002-02-07 US claimed
EP-1153024-B1 2-AMINO-6-ANILINO-PURINES AND THEIR USE AS MEDICAMENTS NOVARTIS AG (CH) 2004-04-28 EP 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-20020016329-A1 2-Amino-6-anilino-purines and their use as medicaments CDK14, CDK1, CCNB1 CDK1 2/4885PDE5A 1437/4885SRC 54/4885

“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.