SCHEMBL6197196

SCHEMBL6197196

Nc1nc(NC2CCN(S(=O)(=O)c3cccnc3)CC2)sc1C(=O)c1c(F)cccc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 8/20 0.53
CCNA2 P20248 5/20 0.53
CDK4 P11802 4/20 0.48
CCND1 P24385 4/20 0.48
CDK1 P06493 2/20 0.48
CDK5 Q00535 2/20 0.47
CDK5R1 Q15078 2/20 0.47
KDM4E B2RXH2 1/20 0.46
POLB P06746 2/20 0.45
CCNT1 O60563 2/20 0.45
CDK9 P50750 2/20 0.45
CDK6 Q00534 2/20 0.45
CDK11A Q9UQ88 2/20 0.45
HTT P42858 2/20 0.45
GSK3B P49841 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
CLK1 P49759 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL6196407 0.91 CDK2 (0.49) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6196326 0.91 CDK2 (0.47) CDK2CCNA2CDK4CCND1CDK1
Hydrochloric Acid SCHEMBL6408432 0.90 CDK2 (0.47) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6197281 0.88 CDK4 (0.50) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6193981 0.88 CDK5 (0.52) CDK2CCNA2CDK4CCND1CDK1
Trifluoroacetic Acid SCHEMBL6197870 0.87 CDK2 (0.46) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6196820 0.87 CDK4 (0.49) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6196776 0.87 CDK4 (0.49) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6409070 0.86 CDK2 (0.46) CDK2CCNA2CDK4CCND1CDK1
SCHEMBL6194364 0.86 CDK4 (0.50) CDK2CCNA2CDK4CCND1CDK1

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-1597256-A1 N-HETEROCYCLYL-SUBSTITUTED AMINO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2005-11-23 EP disclosed
US-20050101595-A1 N-containing cycloalkyl-substituted amino-thiazole derivatives and pharmaceutical compositions for inhibiting cell proliferation and methods for their use PFIZER INC. 2005-05-12 US disclosed
WO-2004074283-A1 N-HETEROCYCLYL-SUBSTITUTED AMINO-THIAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2004-09-02 WO 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-20050101595-A1 N-containing cycloalkyl-substituted amino-thiazole derivatives and pharmaceutical compositions for inhibiting cell proliferation and methods for their use CCNI, MKI67, TK1 CDK2 6/4885CCNA2 109/4885CDK4 78/4885

“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.