SCHEMBL30011984

SCHEMBL30011984

CC(C)c1c(=O)n(C)n2cnc3ccc(-c4ccc(N5CCC(N(C)C)CC5)c(Cl)c4)cc3c12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 4/20 0.45
▸ ATR Q13535 3/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ MTOR P42345 1/20 0.45
▸ TLR9 Q9NR96 1/20 0.40
▸ TLR8 Q9NR97 1/20 0.40
▸ TLR7 Q9NYK1 1/20 0.40
▸ JAK1 P23458 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ MELK Q14680 9/20 0.39
▸ WEE1 P30291 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ MCHR1 Q99705 1/20 0.36

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
SCHEMBL29217613 1.00 ATM (0.45) ATMATRPIK3CAMTORTLR9
SCHEMBL30012314 0.90 ATM (0.48) ATMATRPIK3CAMTORTLR9
SCHEMBL29217588 0.90 ATM (0.48) ATMATRPIK3CAMTORTLR9
SCHEMBL30012567 0.89 MTOR (0.45) ATMATRPIK3CAMTORTLR9
SCHEMBL29217578 0.89 MTOR (0.45) ATMATRPIK3CAMTORTLR9
SCHEMBL30839640 0.84 ATM (0.41) ATMATRPIK3CAMTORJAK1
SCHEMBL30012532 0.84 ATM (0.41) ATMATRPIK3CAMTORJAK1
SCHEMBL30011461 0.76 ATM (0.42) ATMATRPIK3CAMTORMELK
SCHEMBL30011050 0.74 MTOR (0.41) ATMATRPIK3CAMTORMELK
SCHEMBL29217570 0.71 ATM (0.52) ATMATRPIK3CAMTORTLR9

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
CN-114026097-B Substituted pyrazoloquinazolinone compounds and uses thereof 上海瑛派药业有限公司 2024-02-23 — — CN claimed
US-20220259211-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONE COMPOUNDS AND APPLICATION THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-08-18 — — US claimed
CN-114026097-B Substituted pyrazoloquinazolinone compounds and uses thereof 上海瑛派药业有限公司 2024-02-23 — — CN disclosed
US-20220259211-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONE COMPOUNDS AND APPLICATION THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-08-18 — — US 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-20220259211-A1 SUBSTITUTED PYRAZOLOQUINAZOLINONE COMPOUNDS AND APPLICATION THEREOF CHEK1, CHEK2, ATM ATM 3/4885ATR 4/4885PIK3CA 381/4885

“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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