SCHEMBL20138790

SCHEMBL20138790

CCn1nccc1-c1nc(C2CCCC2)c(Br)c(=O)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 5/20 0.36
PDE1A P54750 5/20 0.36
PDE1B Q01064 5/20 0.36
PDE1C Q14123 5/20 0.36
CXCR2 P25025 1/20 0.35
ABL1 P00519 1/20 0.33
ADORA1 P30542 2/20 0.32
ADRA1A P35348 1/20 0.32
ADORA2A P29274 2/20 0.32
ADORA2B P29275 2/20 0.32
CCNK O75909 1/20 0.32
CDK12 Q9NYV4 1/20 0.32
PDE7A Q13946 3/20 0.31
CHEK1 O14757 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
KMT2A Q03164 1/20 0.31
AKT1 P31749 1/20 0.30

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
SCHEMBL21531649 0.91 ADORA1 (0.35) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20139186 0.86 PDE5A (0.36) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20139187 0.85 PDE7A (0.36) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20139185 0.78 ADORA1 (0.35) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20138922 0.77 HTR7 (0.36) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20138756 0.75 ADORA2B (0.37) ADORA1ADORA2AADORA2BADORA3KMT2A
SCHEMBL20138776 0.73 ADORA1 (0.35) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20139192 0.73 HTR1A (0.33) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20138928 0.71 PDE7A (0.37) PDE5APDE1APDE1BPDE1CCXCR2
SCHEMBL20138777 0.71 CREBBP (0.43) CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11766434-B2 Pyrimidinone derivatives as CDC7 inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-09-26 US claimed
US-20220079942-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-03-17 US claimed
US-11020396-B2 Pyrimidinone derivatives as Cdc7 inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-06-01 US claimed
US-20190336502-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-11-07 US claimed
EP-3538523-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS Cancer Research Technology Limited (GB) 2019-09-18 EP claimed
WO-2018087527-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-05-17 WO claimed
US-11766434-B2 Pyrimidinone derivatives as CDC7 inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-09-26 US disclosed
CN-110088100-B Pyrimidone derivatives as CDC7 inhibitors 癌症研究科技有限公司 2023-02-17 CN disclosed
US-20220079942-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-03-17 US disclosed
US-11020396-B2 Pyrimidinone derivatives as Cdc7 inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-06-01 US disclosed
US-20190336502-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-11-07 US disclosed
EP-3538523-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS Cancer Research Technology Limited (GB) 2019-09-18 EP disclosed
WO-2018087527-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-05-17 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 (4 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-20190336502-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CDC7, CDK7, CDK17 PDE5A 2340/4885PDE1A 2729/4885PDE1B 2759/4885
US-11766434-B2 Pyrimidinone derivatives as CDC7 inhibitors CDC7, CDK7, CDK17 PDE5A 2340/4885PDE1A 2729/4885PDE1B 2759/4885
US-20220079942-A1 PYRIMIDINONE DERIVATIVES AS CDC7 INHIBITORS CDC7, CDK7, CDK17 PDE5A 2340/4885PDE1A 2729/4885PDE1B 2759/4885
US-11020396-B2 Pyrimidinone derivatives as Cdc7 inhibitors CDC7, CDK7, CDK17 PDE5A 2340/4885PDE1A 2729/4885PDE1B 2759/4885

“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.