SCHEMBL6574942

SCHEMBL6574942

CCn1cnc2c(Nc3ccc(S(=O)(=O)NCc4ccccc4)cc3)nc(NC3CCC(O)CC3)nc21

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 13/20 0.67
FLT3 P36888 1/20 0.53
SRC P12931 1/20 0.53
CCNE1 P24864 5/20 0.52
CDK2 P24941 5/20 0.52
PDGFRA P16234 4/20 0.52
PRKCA P17252 1/20 0.51
CCNE2 O96020 1/20 0.50
CCNA2 P20248 1/20 0.50
CCNA1 P78396 1/20 0.50
CCNB2 O95067 1/20 0.47
CCNB1 P14635 1/20 0.47
CCNB3 Q8WWL7 1/20 0.47

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
SCHEMBL6574939 1.00 CDK1 (0.67) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6574802 0.92 CDK1 (0.62) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6574807 0.92 CDK1 (0.62) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6576931 0.91 CDK1 (0.71) CDK1CCNE1CDK2PDGFRAPRKCA
SCHEMBL6576936 0.91 CDK1 (0.71) CDK1CCNE1CDK2PDGFRAPRKCA
SCHEMBL6576046 0.90 CDK1 (0.70) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6576038 0.90 CDK1 (0.70) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6576111 0.89 CDK1 (0.62) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6576044 0.89 CDK1 (0.71) CDK1FLT3SRCCCNE1CDK2
SCHEMBL6574768 0.89 CDK1 (0.71) CDK1SRCCCNE1CDK2PDGFRA

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 2/4885FLT3 357/4885SRC 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.