SCHEMBL11352811

SCHEMBL11352811

COc1ccc2c(c1)C(=O)C=CC2=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA4 P22748 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
TOP1 P11387 1/20 0.51
MAPT P10636 5/20 0.50
RAB9A P51151 3/20 0.50
NPSR1 Q6W5P4 3/20 0.50
PKM P14618 3/20 0.50
MCL1 Q07820 3/20 0.50
KDM4E B2RXH2 3/20 0.50
HKDC1 Q2TB90 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
IDO1 P14902 2/20 0.49
APAF1 O14727 1/20 0.49
PABPC1 P11940 1/20 0.49
CDC25A P30304 1/20 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
SCHEMBL31439223 0.83 CA2 (0.50) CA1CA2CA4CA7CA9
SCHEMBL1893435 0.83 CA9 (0.50) CA1CA2CA4CA7CA9
SCHEMBL12947560 0.83 GSTP1 (0.56) CA1CA2CA4CA7CA9
SCHEMBL7038422 0.83 CA2 (0.50) CA1CA2CA4CA7CA9
Indole SCHEMBL28688523 0.79 MEN1 (0.53) CA1CA2CA4CA7CA9
SCHEMBL12000834 0.78 PTPN1 (0.49) CA1CA2CA4CA7CA9
SCHEMBL30492234 0.78 IDO1 (0.52) CA1CA2CA4CA7CA9
SCHEMBL9067171 0.78 IDO1 (0.52) CA1CA2CA4CA7CA9
SCHEMBL29262416 0.78 TOP1 (0.60) CA1CA4CA7CA9TOP1
SCHEMBL23111388 0.77 CA1 (0.57) CA1CA2CA4CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117024408-A 1,2, 3-triaryl substituted benzo [ f ] isoindole-4, 9-dione compound and preparation method and application thereof 湘潭大学 2023-11-10 CN claimed
CN-117024408-A 1,2, 3-triaryl substituted benzo [ f ] isoindole-4, 9-dione compound and preparation method and application thereof 湘潭大学 2023-11-10 CN disclosed
CN-114276227-B Aurora kinase inhibitor and application thereof in preparation of antitumor drugs 山东省千佛山医院 2023-10-13 CN disclosed
CN-109553756-B Method for producing phosphorus-containing epoxy resin 日铁化学材料株式会社 2023-09-29 CN disclosed
US-11613509-B2 Radical polymerization control agent and radical polymerization control method KAWASAKI KASEI CHEMICALS LTD. (JP) 2023-03-28 US disclosed
CN-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed
CN-114276227-A Aurora kinase inhibitor and application thereof in preparation of antitumor drugs 山东省千佛山医院 2022-04-05 CN disclosed
US-20210122692-A1 RADICAL POLYMERIZATION CONTROL AGENT AND RADICAL POLYMERIZATION CONTROL METHOD KAWASAKI KASEI CHEMICALS LTD. (JP) 2021-04-29 US disclosed
CN-110891980-A Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2020-03-17 CN disclosed
EP-0002310-B1 4,9-DIHYDRO-4,9-DIOXO-1H-NAPHTHO(2,3-D) TRIAZOLES, THEIR PREPARATION AND ANTIALLERGIC COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1981-06-24 EP disclosed
US-4263309-A ASTHMA, HAY FEVER, RHINITIS BEECHAM GROUP LIMITED (GB) 1981-04-21 US disclosed
EP-0002310-A1 4,9-Dihydro-4,9-dioxo-1H-naphtho(2,3-d) triazoles, their preparation and antiallergic compositions containing them BEECHAM GROUP PLC (GB) 1979-06-13 EP 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-11613509-B2 Radical polymerization control agent and radical polymerization control method PPOX, NOX4, CROCC CA1 1537/4885CA2 1806/4885CA4 1224/4885
US-20210122692-A1 RADICAL POLYMERIZATION CONTROL AGENT AND RADICAL POLYMERIZATION CONTROL METHOD PPOX, NOX4, CROCC CA1 1537/4885CA2 1806/4885CA4 1224/4885

“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.