SCHEMBL4419088

SCHEMBL4419088

Nc1nc(Nc2ccc(NS(=O)(=O)c3ccccc3)cc2)ccc1C(=O)c1c(F)cccc1F

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 4/20 0.74
PKM P14618 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44
KEAP1 Q14145 1/20 0.43
GPR27 Q9NS67 5/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
AVPR2 P30518 1/20 0.42
HDAC4 P56524 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CDK1 P06493 1/20 0.40
GAA P10253 1/20 0.40
GFER P55789 1/20 0.40

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
SCHEMBL4416712 0.87 CDK2 (0.74) CDK2MEN1KMT2A
SCHEMBL4419524 0.85 CDK2 (1.00) CDK2CDK1
SCHEMBL4414254 0.83 CDK2 (0.77) CDK2MEN1KMT2ACDK1
SCHEMBL4413597 0.82 CDK2 (0.72) CDK2CDK1
SCHEMBL6027265 0.81 CDK2 (0.73) CDK2MEN1KMT2AGAA
SCHEMBL6695987 0.76 CDK2 (0.59) CDK2MEN1KMT2A
SCHEMBL4411192 0.75 CDK2 (0.61) CDK2MEN1KMT2ACDK1
SCHEMBL4412149 0.73 CDK2 (0.81) CDK2CDK1
SCHEMBL4411104 0.69 CDK2 (0.72) CDK2MEN1KMT2AALDH1A1CDK1
SCHEMBL6027091 0.69 CDK2 (0.54) CDK2MEN1KMT2ACDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689394-A4 AMINO SUBSTITUTED PYRIDINYL METHANONE COMPOUNDS USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2009-06-03 EP disclosed
US-7109220-B2 Amino substituted pyridinyl methanone compounds useful in treating kinase disorders JANSSEN PHARMACEUTICA N.V. (BE) 2006-09-19 US disclosed
EP-1689394-A1 AMINO SUBSTITUTED PYRIDINYL METHANONE COMPOUNDS USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA N.V. (BE) 2006-08-16 EP disclosed
WO-2005051387-A1 AMINO SUBSTITUTED PYRIDINYL METHANONE COMPOUNDS USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA N.V. (BE) 2005-06-09 WO disclosed
US-20050124610-A1 Amino substituted pyridinyl methanone compounds useful in treating kinase disorders JANSSEN PHARMACEUTICA N. V. (BE) 2005-06-09 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-20050124610-A1 Amino substituted pyridinyl methanone compounds useful in treating kinase disorders CDK6, CDK1, CDK3 CDK2 4/4885PKM 153/4885FFAR4 4780/4885

“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.