SCHEMBL20011907

SCHEMBL20011907

CC(C)(C)OC(=O)N1CCN(c2nc(-c3ccncc3F)nc(Cl)c2Cl)CC(F)(F)C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.46
GBA1 P04062 2/20 0.42
CYP3A4 P08684 2/20 0.40
CYP3A5 P20815 2/20 0.40
POLB P06746 1/20 0.37
CYP11B2 P19099 1/20 0.36
KIT P10721 1/20 0.35
CCNK O75909 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCND3 P30281 1/20 0.35
CDK9 P50750 1/20 0.35
CDK6 Q00534 1/20 0.35
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35
SKP2 Q13309 1/20 0.35

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
SCHEMBL30063195 1.00 GPR119 (0.46) GPR119GBA1CYP3A4CYP3A5POLB
SCHEMBL30060985 0.86 GPR119 (0.42) GPR119GBA1CYP3A4CYP3A5CYP11B2
SCHEMBL20011911 0.86 GPR119 (0.42) GPR119GBA1CYP3A4CYP3A5CYP11B2
SCHEMBL30060981 0.81 GBA1 (0.40) GPR119GBA1CYP3A4CYP3A5POLB
SCHEMBL20011851 0.81 GBA1 (0.40) GPR119GBA1CYP3A4CYP3A5POLB
SCHEMBL20012043 0.78 POLB (0.38) GPR119GBA1POLBCYP11B2KIT
SCHEMBL20139189 0.78 GBA1 (0.38) GPR119GBA1POLBCYP11B2CCNK
SCHEMBL30234939 0.78 GBA1 (0.38) GPR119GBA1POLBCYP11B2CCNK
SCHEMBL30062956 0.77 POLB (0.37) GPR119GBA1CYP3A4CYP3A5POLB
SCHEMBL20011908 0.77 POLB (0.37) GPR119GBA1CYP3A4CYP3A5POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919896-B2 Preparation and uses of pyrimidinone derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-02-16 US disclosed
US-10919896-B2 Preparation and uses of pyrimidinone derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-02-16 US disclosed
EP-3515903-B1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVES CANCER RESEARCH TECH LTD (GB) 2020-10-21 EP disclosed
EP-3515903-B1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVES CANCER RESEARCH TECH LTD (GB) 2020-10-21 EP disclosed
US-20200123157-A1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVE TEVA BRANDED PHARMACEUTICAL PRODUCTS R&D, INC. 2020-04-23 US disclosed
US-20200123157-A1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVE TEVA BRANDED PHARMACEUTICAL PRODUCTS R&D, INC. 2020-04-23 US disclosed
WO-2018055402-A1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVES CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-03-29 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 (2 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-10919896-B2 Preparation and uses of pyrimidinone derivatives CDC7, CDK7, CDK17 GPR119 3920/4885GBA1 3433/4885CYP3A4 3090/4885
US-20200123157-A1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVE CDC7, CDK7, CDK17 GPR119 3926/4885GBA1 3457/4885CYP3A4 3038/4885

“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.