SCHEMBL578250

SCHEMBL578250

Cc1ccc2c(c1)C(=O)C(=O)N2Cc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.74
ALDH1A1 P00352 5/20 0.71
ALDH2 P05091 3/20 0.71
ALDH3A1 P30838 3/20 0.71
HSP90AA1 P07900 1/20 0.69
CHRM1 P11229 1/20 0.67
CES1 P23141 1/20 0.67
MAPT P10636 3/20 0.66
TP53 P04637 2/20 0.66
CA12 O43570 1/20 0.64
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
CA9 Q16790 1/20 0.64
CASP3 P42574 2/20 0.63
CASP7 P55210 2/20 0.63
CASP6 P55212 2/20 0.63
CASP1 P29466 1/20 0.63
CASP4 P49662 1/20 0.63
CASP9 P55211 1/20 0.63
CASP8 Q14790 1/20 0.63

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
SCHEMBL28220867 0.91 ACHE (0.63) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL16329852 0.91 ACHE (0.83) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL27866584 0.88 ALDH1A1 (0.67) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL4597228 0.87 ACHE (0.77) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL16048068 0.85 ALDH1A1 (0.71) ACHEALDH1A1ALDH2ALDH3A1MAPT
SCHEMBL28719173 0.85 ACHE (0.56) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL22410741 0.85 ACHE (0.75) ACHEALDH1A1ALDH3A1HSP90AA1MAPT
SCHEMBL28053364 0.85 ACHE (1.00) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL14047967 0.85 ACHE (0.75) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1
SCHEMBL16521837 0.85 ACHE (0.56) ACHEALDH1A1ALDH2ALDH3A1HSP90AA1

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107840851-A Indoles spiral shell pyrrole alloxazine compounds and its synthetic method 扬州大学 2018-03-27 CN claimed
CN-118459390-B 3-Hydroxy oxindole derivative containing Z-type 1, 4-dicarbonyl olefin, and preparation method and application thereof SUN YAT-SEN UNIVERSITY (CN) 2026-05-26 CN disclosed
CN-118459390-A 3-Hydroxy oxindole derivative containing Z-type 1, 4-dicarbonyl olefin, and preparation method and application thereof 中山大学 2024-08-09 CN disclosed
US-11858915-B2 Polo like kinase 4 inhibitors ORIC PHARMACEUTICALS, INC. (US) 2024-01-02 US disclosed
US-20230365537-A1 POLO LIKE KINASE 4 INHIBITORS ORIC PHARMACEUTICALS, INC. 2023-11-16 US disclosed
CN-114160206-B Catalyst for catalytic synthesis of optically active indole compound, application and synthesis method thereof, and optically active indole compound 中国科学技术大学 2023-03-10 CN disclosed
CN-114160206-A Catalyst for catalytic synthesis of optically active indole compound, application and synthesis method thereof, and optically active indole compound 中国科学技术大学 2022-03-11 CN disclosed
CN-111423421-B Oxidized indole-substituted gamma-butenolide derivative and preparation method and application thereof 中山大学 2021-09-03 CN disclosed
CN-111423421-A Oxidized indole-substituted gamma-butenolide derivative and preparation method and application thereof 中山大学 2020-07-17 CN disclosed
US-RE47731-E1 Kinase inhibitors and method of treating cancer with same UNIV HEALTH NETWORK (CA) 2019-11-19 US disclosed
EP-2032584-A2 THIADIAZOLE COMPOUNDS AND METHODS OF USE THEREOF Wyeth (US) 2009-03-11 EP disclosed
US-20080194563-A1 Shp-2 Inhibitors, Pharmaceutical Compositons Comprising Them and Their Use For Treating Phosphatase-Mediated Diseases MAX-DELBRUCK-CENTRUM FUR MOLEKULARE MEDIZIN (DE) 2008-08-14 US disclosed
US-20080125469-A1 Thiadiazole compounds and methods of use thereof WYETH (US) 2008-05-29 US disclosed
WO-2007146138-A2 THIADIAZOLE COMPOUNDS AND METHODS OF USE THEREOF WYETH (US) 2007-12-21 WO disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2005-03-10 US disclosed
EP-1487792-A1 DIHYDROINDOL-2-ONE DERIVATIVES AS STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-22 EP disclosed
WO-2003078394-A1 DIHYDROINDOL-2-ONE DERIVATIVES AS STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-25 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 (5 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-20080194563-A1 Shp-2 Inhibitors, Pharmaceutical Compositons Comprising Them and Their Use For Treating Phosphatase-Mediated Diseases PTPN2, PTPRJ, PTPRS ACHE 4845/4885ALDH1A1 3914/4885ALDH2 2820/4885
US-11858915-B2 Polo like kinase 4 inhibitors PLK4, PLK2, PLK3 ACHE 4244/4885ALDH1A1 2211/4885ALDH2 1859/4885
US-20230365537-A1 POLO LIKE KINASE 4 INHIBITORS PLK4, PLK2, PLK3 ACHE 4244/4885ALDH1A1 2211/4885ALDH2 1859/4885
US-20080125469-A1 Thiadiazole compounds and methods of use thereof ADAMTS5, ADAMTS1, TIMP3 ACHE 204/4885ALDH1A1 388/4885ALDH2 277/4885
US-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators NR3C2, NR5A1, NR5A2 ACHE 4757/4885ALDH1A1 723/4885ALDH2 856/4885

“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.