SCHEMBL6181244

SCHEMBL6181244

CC(C)(C)OC(=O)N1CC(Oc2ccc(N=C=S)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.47
GPR119 Q8TDV5 3/20 0.47
NR1H2 P55055 1/20 0.40
CHEK2 O96017 2/20 0.39
ALDH1A1 P00352 1/20 0.39
NAMPT P43490 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
LIPE Q05469 1/20 0.37

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
SCHEMBL6179824 0.91 GPR119 (0.54) USP30GPR119CHEK2ALDH1A1HRH3
SCHEMBL6181852 0.89 CHEK2 (0.51) USP30GPR119CHEK2ALDH1A1HRH3
SCHEMBL24565826 0.82 USP30 (0.40) USP30GPR119LIPE
SCHEMBL29762796 0.82 USP30 (0.40) USP30GPR119LIPE
SCHEMBL28670992 0.81 USP30 (0.53) USP30GPR119NR1H2CHEK2ALDH1A1
SCHEMBL6182215 0.81 USP30 (0.53) USP30GPR119NR1H2CHEK2ALDH1A1
SCHEMBL12788093 0.81 USP30 (0.53) USP30GPR119NR1H2CHEK2ALDH1A1
SCHEMBL3343250 0.80 USP30 (0.52) USP30GPR119NR1H2CHEK2ALDH1A1
SCHEMBL14862587 0.80 USP30 (0.52) USP30GPR119NR1H2CHEK2ALDH1A1
SCHEMBL16434828 0.80 USP30 (0.52) USP30GPR119ALDH1A1LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1507530-B1 DIAMINOTHIAZOLES AND USE THEREOF AS CDK4 INHIBITORS HOFFMANN LA ROCHE (CH) 2005-11-02 EP disclosed
EP-1507530-A1 DIAMINOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2005-02-23 EP disclosed
US-6818663-B2 AS INHIBITORS OF CYCLIN-DEPENDENT KINASE 4 (CDK4); ANTIPROLIFERATIVE AGENTS; FOR THERAPY OF CANCER, TUMORS HOFFMANN-LA ROCHES 2004-11-16 US disclosed
US-20040006058-A1 DIAMINOTHIAZOLES CHU XIN-JIE (US) 2004-01-08 US disclosed
WO-2003097048-A1 DIAMINOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-27 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-20040006058-A1 DIAMINOTHIAZOLES CDK4, CDK1, CDK2 USP30 3539/4885GPR119 2534/4885NR1H2 3041/4885

“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.