SCHEMBL20839860

SCHEMBL20839860

Cc1cc2nnc3c(c2cc1-c1ccc(OCCCN2CCCCC2)cc1)n(C(C)C)c(=O)n3C

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 8/20 0.52
▸ KCNH2 Q12809 7/20 0.52
▸ ADRA1A P35348 6/20 0.52
▸ ATM Q13315 6/20 0.52
▸ ATR Q13535 2/20 0.51
▸ HTR3A P46098 5/20 0.49

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
SCHEMBL20839262 0.91 ATM (0.63) HRH3KCNH2ADRA1AATMATR
SCHEMBL20844075 0.90 ATM (0.66) KCNH2ATMATR
SCHEMBL20839934 0.88 ATM (0.61) HRH3KCNH2ADRA1AATMATR
SCHEMBL20839282 0.87 ATM (0.60) HRH3KCNH2ADRA1AATMATR
SCHEMBL20843843 0.85 ATM (0.59) HRH3KCNH2ATMATR
SCHEMBL30189158 0.81 ATM (0.79) KCNH2ATMATR
SCHEMBL20844074 0.81 ATM (0.79) KCNH2ATMATR
SCHEMBL30189160 0.81 ATM (0.79) KCNH2ATMATR
SCHEMBL20840080 0.80 ATM (0.61) HRH3KCNH2ADRA1AATMATR
SCHEMBL21802025 0.80 ATM (0.78) KCNH2ATMATR

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 4 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
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 HRH3 673/4885KCNH2 4793/4885ADRA1A 3756/4885

“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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