SCHEMBL6701026

SCHEMBL6701026

Nc1nc(Nc2ccc(S(=O)(=O)NCCCCO)cc2)sc1C(=O)c1c(F)cccc1F

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 14/20 0.54
CDK2 P24941 14/20 0.54
CCNT1 O60563 3/20 0.54
CDK4 P11802 3/20 0.54
CCND1 P24385 3/20 0.54
CDK9 P50750 3/20 0.54
CDK6 Q00534 3/20 0.54
CDK11A Q9UQ88 3/20 0.54
CDK5 Q00535 3/20 0.47
CDK5R1 Q15078 3/20 0.47
CCNE1 P24864 1/20 0.46

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
SCHEMBL6195665 0.99 CCNA2 (0.53) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6211465 0.94 CCNA2 (0.56) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6192807 0.90 CCNB2 (0.55) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6194606 0.90 CCNT1 (0.53) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6194975 0.89 CCNT1 (0.52) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6195125 0.89 CCNT1 (0.52) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6194531 0.89 CCNA2 (0.51) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6193477 0.89 CCNA2 (0.52) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6194186 0.88 CCNT1 (0.57) CCNA2CDK2CCNT1CDK4CCND1
SCHEMBL6194698 0.88 CCNT1 (0.51) CCNA2CDK2CCNT1CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040176431-A1 Antiproliferative 2-(sulfo-phenyl)-aminothiazole derivatives and pharmaceutical compositions, and methods for their use PFIZER, INC. 2004-09-09 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-20040176431-A1 Antiproliferative 2-(sulfo-phenyl)-aminothiazole derivatives and pharmaceutical compositions, and methods for their use MKI67, TK1, CDK2 CCNA2 138/4885CDK2 3/4885CCNT1 7/4885

“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.