SCHEMBL20839282

SCHEMBL20839282

CC(C)n1c(=O)n(C)c2nnc3ccc(-c4ccc(OCCCN5CCCC5)cc4)cc3c21

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 8/20 0.60
▸ ATR Q13535 2/20 0.59
▸ HRH3 Q9Y5N1 9/20 0.51
▸ KCNH2 Q12809 4/20 0.51
▸ ADRA1A P35348 3/20 0.51
▸ HTR3A P46098 3/20 0.47
▸ MTOR P42345 1/20 0.44

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
SCHEMBL20839934 0.99 ATM (0.61) ATMATRHRH3KCNH2ADRA1A
SCHEMBL20839523 0.88 ATM (0.77) ATMATRKCNH2MTOR
SCHEMBL20839860 0.87 HRH3 (0.52) ATMATRHRH3KCNH2ADRA1A
SCHEMBL20839262 0.86 ATM (0.63) ATMATRHRH3KCNH2ADRA1A
SCHEMBL18824736 0.85 ATM (0.81) ATMATRKCNH2MTOR
SCHEMBL20839257 0.85 ATM (0.74) ATMATRMTOR
SCHEMBL18824613 0.84 ATM (0.78) ATMATRKCNH2MTOR
SCHEMBL30972061 0.84 ATM (0.58) ATMATRKCNH2MTOR
SCHEMBL20840080 0.83 ATM (0.61) ATMATRHRH3KCNH2ADRA1A
SCHEMBL20839345 0.83 ATM (0.52) ATMATRHRH3KCNH2ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019057757-A1 1,3-DIHYDROIMIDAZO[4,5-C]CINNOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2019-03-28 — — WO claimed
US-20230256110-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATM INHIBITOR ASTRAZENECA UK LIMITED (GB) 2023-08-17 — — US disclosed
EP-4171651-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATM INHIBITOR AstraZeneca UK Limited (GB) 2023-05-03 — — EP disclosed
WO-2021260580-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATM INHIBITOR ASTRAZENECA UK LIMITED (GB) 2021-12-30 — — WO disclosed
WO-2019057757-A1 1,3-DIHYDROIMIDAZO[4,5-C]CINNOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2019-03-28 — — WO disclosed
WO-2019057757-A1 1,3-DIHYDROIMIDAZO[4,5-C]CINNOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2019-03-28 — — 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-20230256110-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATM INHIBITOR ATM, CHEK2, ERBB2 ATM 1/4885ATR 7/4885HRH3 673/4885

“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.

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