SCHEMBL20011965

SCHEMBL20011965

CC(=O)Nc1ccc(C(=O)N2CCC(c3nc(-c4ccncc4)[nH]c(=O)c3Cl)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
KDM4E B2RXH2 4/20 0.42
GAA P10253 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
CRBN Q96SW2 1/20 0.41
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
CYP2C19 P33261 1/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
PIK3CG P48736 1/20 0.39
NAMPT P43490 1/20 0.38
HTT P42858 1/20 0.38
PTPN1 P18031 1/20 0.38
MAPT P10636 2/20 0.38
SYK P43405 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL20011978 0.90 HSD11B1 (0.41) KDM4EGAAHPGDPOLBKMT2A
SCHEMBL20011818 0.86 HTR2B (0.44) TSHRKDM4EALDH1A1HPGDKMT2A
SCHEMBL22563117 0.84 LMNA (0.40) TSHRKDM4EGAAHPGDPOLB
SCHEMBL20011817 0.84 MAPK11 (0.48) TSHR
SCHEMBL20011834 0.84 FASN (0.46) CYP2C19CYP3A4
SCHEMBL19995440 0.83 MAPT (0.47) TSHRKDM4EGAAALDH1A1POLB
SCHEMBL22563132 0.83 LMNA (0.41) KDM4EGAAALDH1A1HPGDPOLB
SCHEMBL20011993 0.82 LSS (0.41) KDM4EGAAALDH1A1HPGDPOLB
SCHEMBL30060715 0.82 NAMPT (0.38) KDM4EGAAHPGDPOLBNAMPT
SCHEMBL20011838 0.82 NAMPT (0.38) KDM4EGAAHPGDPOLBNAMPT

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 10 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 claimed
EP-3515903-B1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVES CANCER RESEARCH TECH LTD (GB) 2020-10-21 EP claimed
US-20200123157-A1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVE TEVA BRANDED PHARMACEUTICAL PRODUCTS R&D, INC. 2020-04-23 US claimed
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 TSHR 4193/4885KDM4E 1628/4885GAA 1817/4885
US-20200123157-A1 PREPARATION AND USES OF PYRIMIDINONE DERIVATIVE CDC7, CDK7, CDK17 TSHR 4198/4885KDM4E 1583/4885GAA 1892/4885

“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.