SCHEMBL7515922

SCHEMBL7515922

CC(=O)Nc1ncc(CCCc2ncc(C(C)(C)C)o2)s1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 13/20 0.63
CCNE1 P24864 13/20 0.63
CDK2 P24941 13/20 0.63
CDK4 P11802 7/20 0.63
CCND1 P24385 7/20 0.63
CCNB2 O95067 5/20 0.63
CDK1 P06493 5/20 0.63
CCNB1 P14635 5/20 0.63
CCNB3 Q8WWL7 5/20 0.63
CCND3 P30281 4/20 0.63
CCND2 P30279 1/20 0.63
MAPK14 Q16539 1/20 0.48
HDAC3 O15379 3/20 0.48
HDAC4 P56524 3/20 0.48
CDK6 Q00534 3/20 0.48
HDAC1 Q13547 3/20 0.48
HDAC7 Q8WUI4 3/20 0.48
HDAC2 Q92769 3/20 0.48
HDAC10 Q969S8 3/20 0.48
HDAC11 Q96DB2 3/20 0.48

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
SCHEMBL5725573 0.93 CCNE2 (0.65) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL7522567 0.80 CCNE2 (0.55) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL4734684 0.77 CCNE2 (1.00) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL24732259 0.76 CDK2 (0.64) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL7507195 0.75 CCNE2 (0.59) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL5725741 0.75 CDK2 (0.65) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL7517274 0.75 CCNE2 (0.53) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL18135139 0.74 CDK2 (0.64) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL21359490 0.73 AOC3 (0.55) CCNE2CCNE1CDK2CDK4CCND1
SCHEMBL21770026 0.73 CDK2 (0.53) CCNE2CCNE1CDK2CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020165259-A1 Carbon substituted aminothiazole inhibitors of cyclin dependent kinases RAWLINS DAVID B (US) 2002-11-07 US claimed
EP-1087951-A4 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL MYERS SQUIBB CO (US) 2002-08-14 EP claimed
EP-1087951-A1 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2001-04-04 EP claimed
WO-1999065884-A1 CARBON SUBSTITUTED AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL-MYERS SQUIBB COMPANY (US) 1999-12-23 WO claimed

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-20020165259-A1 Carbon substituted aminothiazole inhibitors of cyclin dependent kinases CCNK, CDK2, CCNL2 CCNE2 23/4885CCNE1 12/4885CDK2 2/4885

“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.