SCHEMBL5836016

SCHEMBL5836016

CC(C)c1cnc(NC(=O)CCCC(=O)c2ccccc2)s1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 6/20 0.65
CDK2 P24941 6/20 0.65
CDK5 Q00535 6/20 0.65
CCNT1 O60563 1/20 0.65
ALDH1A1 P00352 1/20 0.65
CDK1 P06493 1/20 0.65
CDK4 P11802 1/20 0.65
CCNB1 P14635 1/20 0.65
CCNA2 P20248 1/20 0.65
CCND1 P24385 1/20 0.65
CDK7 P50613 1/20 0.65
CDK9 P50750 1/20 0.65
CCNH P51946 1/20 0.65
MNAT1 P51948 1/20 0.65
CDK5R1 Q15078 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
GAA P10253 1/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL5835404 0.85 CCNE1 (0.75) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL6191790 0.85 CDK2 (0.62) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL21533571 0.84 SMN1; SMN2 (0.60) SMN1; SMN2KMT2A
SCHEMBL21533498 0.83 CCNE1 (0.65) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL5835423 0.82 CDK2 (0.56) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL5836598 0.81 CCNE1 (0.77) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL5835952 0.81 CCNE1 (0.61) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL5837242 0.80 CDK2 (0.56) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL6173277 0.80 CCNE1 (0.66) CCNE1CDK2CDK5CCNT1ALDH1A1
SCHEMBL5836102 0.79 CDK2 (1.00) CCNE1CDK2CDK5CCNT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US claimed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP claimed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP claimed
CN-1325389-A 2-aminothiazole derivatives, process for preparing the same and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN claimed
US-20190330167-A1 ACTIVATORS OF HIV LATENCY THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2019-10-31 US disclosed
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US disclosed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP disclosed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP disclosed
CN-1325389-A 2-aminothiazole derivatives, process for preparing the same and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN 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-20190330167-A1 ACTIVATORS OF HIV LATENCY NFATC1, EP300, CD69 CCNE1 785/4885CDK2 120/4885CDK5 37/4885

“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.