SCHEMBL951019

SCHEMBL951019

CCc1cccc2c1NC(=O)C2=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.61
CES1 P23141 5/20 0.56
NSD2 O96028 1/20 0.56
BCHE P06276 1/20 0.56
LIG1 P18858 1/20 0.51
PDK2 Q15119 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
CASP3 P42574 1/20 0.45
CASP2 P42575 1/20 0.45
CASP7 P55210 1/20 0.45
CASP6 P55212 1/20 0.45
CASP8 Q14790 1/20 0.45
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
CYP2D6 P10635 1/20 0.40
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
POLB P06746 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALDH2 P05091 1/20 0.37

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
SCHEMBL5329335 0.87 DAO (0.56) DAOCES1NSD2BCHELIG1
SCHEMBL9686821 0.83 DAO (0.51) DAOCES1NSD2BCHELIG1
SCHEMBL10648890 0.83 CES1 (0.55) DAOCES1NSD2BCHELIG1
SCHEMBL20303987 0.83 CES1 (0.55) DAOCES1NSD2BCHELIG1
SCHEMBL3088689 0.76 DAO (1.00) DAOCES1NSD2BCHELIG1
SCHEMBL24673381 0.76 CASP3 (0.51) DAOPDK2CASP3CASP2CASP7
SCHEMBL5329295 0.75 DAO (0.54) DAOCES1NSD2BCHELIG1
Hydrochloric Acid SCHEMBL11430657 0.74 DAO (0.96) DAOCES1NSD2BCHELIG1
SCHEMBL27941923 0.74 DAO (0.49) DAOCES1NSD2BCHELIG1
SCHEMBL4182713 0.74 DAO (0.53) DAOCES1NSD2BCHELIG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116158489-B Method for producing biological fermentation feed by using saccharomyces cerevisiae 内蒙古海邻科技发展有限公司 2023-07-18 CN claimed
CN-116158489-A Method for producing biological fermentation feed by using saccharomyces cerevisiae 内蒙古海邻科技发展有限公司 2023-05-26 CN claimed
CN-102690226-A Multi-nitrogen substituted isatin derivative and synthetic method of multi-nitrogen substituted isatin derivative UNIV GUANGDONG TECHNOLOGY 2012-09-26 CN claimed
WO-2007132280-A1 ISATIN AND ITS DERIVATIVES FOR USE AS A MEDICAMENT Szegedi Tudományegyetem (HU) 2007-11-22 WO claimed
CN-116158489-B Method for producing biological fermentation feed by using saccharomyces cerevisiae 内蒙古海邻科技发展有限公司 2023-07-18 CN disclosed
CN-116158489-A Method for producing biological fermentation feed by using saccharomyces cerevisiae 内蒙古海邻科技发展有限公司 2023-05-26 CN disclosed
CN-105732476-B A kind of carbazole isatin type compound and its preparation method and purposes 吉首大学 2017-12-01 CN disclosed
EP-2666772-B1 Synthesis of amines and intermediates for the synthesis thereof BASF SE (DE) 2017-03-01 EP disclosed
EP-1572647-B1 SYNTHESIS OF AMINES AND INTERMEDIATES FOR THE SYNTHESIS THEREOF BASF SE (DE) 2016-09-21 EP disclosed
CN-105732476-A Carbazole-isatin type compound and preparation method and application thereof 吉首大学 2016-07-06 CN disclosed
CN-105541808-A Metronidazole-isatin type compound as well as preparation method and application thereof UNIV JISHOU 2016-05-04 CN disclosed
CN-1729174-B The synthesis of amine and the intermediate for the synthesis of amine CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2015-10-21 CN disclosed
WO-2005047257-A2 METHODS AND COMPOSITIONS FOR SELECTIN INHIBITION WYETH (US) 2005-05-26 WO disclosed
US-20050101568-A1 Methods and compositions for selectin inhibition WYETH (US) 2005-05-12 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-2004056769-A2 SYNTHESIS OF AMINES AND INTERMEDIATES FOR THE SYNTHESIS THEREOF CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-07-08 WO disclosed
WO-2003078394-A1 DIHYDROINDOL-2-ONE DERIVATIVES AS STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-25 WO disclosed
US-4256640-A ANTIINFLAMMATORY AGENTS, ANALGESICS SHIONOGI & CO., LTD. (JP) 1981-03-17 US disclosed
US-4110466-A FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-08-29 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 (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-20050101568-A1 Methods and compositions for selectin inhibition SELP, SELE, SELL DAO 1610/4885CES1 707/4885NSD2 4259/4885
US-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators NR3C2, NR5A1, NR5A2 DAO 4053/4885CES1 1572/4885NSD2 3479/4885

“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.