SCHEMBL6698526

SCHEMBL6698526

Nc1nc(Nc2ccc(S(=O)(=O)NC3CCNCC3)cc2)sc1C(=O)c1c(F)cccc1F

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
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
CCNA2 P20248 13/20 0.52
CDK2 P24941 13/20 0.52
CDK5 Q00535 4/20 0.52
CDK5R1 Q15078 4/20 0.52

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
SCHEMBL5726084 0.87 CCNT1 (0.52) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL6194895 0.82 CCNT1 (0.53) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL5725714 0.82 CCNT1 (0.62) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL6701037 0.82 CCNT1 (0.65) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL18007048 0.82 CDK2 (0.54) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL6195100 0.81 CCNT1 (0.49) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL6191533 0.81 CCNA2 (0.63) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL3384293 0.81 CDK5 (0.76) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL5725752 0.81 CDK2 (0.76) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL6695987 0.81 CDK2 (0.59) CCNT1CDK4CCND1CDK9CDK6

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 CCNT1 7/4885CDK4 15/4885CCND1 75/4885

“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.