SCHEMBL4384462

SCHEMBL4384462

C[C@@]1(c2ccccc2)NC(=O)NC1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
CYP2C9 P11712 2/20 0.59
CACNA1F O60840 1/20 0.59
MAPT P10636 1/20 0.59
HTR2A P28223 1/20 0.59
HRH1 P35367 1/20 0.59
SCN1A P35498 1/20 0.59
SCN4A P35499 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59
CACNA1D Q01668 1/20 0.59
KCNH2 Q12809 1/20 0.59
CACNA1S Q13698 1/20 0.59
CACNA1C Q13936 1/20 0.59
SCN5A Q14524 1/20 0.59
SCN2A Q99250 1/20 0.59
SCN3A Q9NY46 1/20 0.59
MMP2 P08253 1/20 0.59
MMP9 P14780 1/20 0.59
TNKS O95271 1/20 0.56

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
SCHEMBL4384456 1.00 ALDH1A1 (0.59) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL542865 1.00 ALDH1A1 (0.59) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL6282916 0.98 ALDH1A1 (0.57) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL542225 0.89 TNKS (0.62) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL542561 0.82 LMNA (0.53) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL1092035 0.82 MEN1 (0.49) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL20134878 0.82 LMNA (0.53) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL4380000 0.82 MEN1 (0.49) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL4380003 0.82 MEN1 (0.49) ALDH1A1CYP2C9CACNA1FMAPTHTR2A
SCHEMBL10131744 0.80 LMNA (0.51) ALDH1A1CYP2C9CACNA1FMAPTHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0903353-B1 Imidazolidine derivates, their preparation and use, and pharmaceutical compositions containing them SANOFI AVENTIS DEUTSCHLAND (DE) 2009-11-25 EP disclosed
EP-0816343-B1 Process for the preparation of chiral, non-racemic (4-aryl-2,5-dioxoimidazolidin-1-yl)-acetic acids SANOFI AVENTIS DEUTSCHLAND (DE) 2005-12-14 EP disclosed
US-6759424-B2 2,5-DIOXOIMIDAZOLIDINE OR 2-THIO-5-OXOIMIDAZOLIDINE DERIVATIVES SUITABLE FOR THE THERAPY AND PROPHYLAXIS OF INFLAMMATORY DISORDERS, FOR EXAMPLE OF RHEUMATOID ARTHRITIS, OR OF ALLERGIC DISORDER AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-07-06 US disclosed
US-20030125565-A1 Imidazolidine derivatives, their preparation, their use, and pharmaceutical preparations comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-07-03 US disclosed
US-6423712-B1 2,4-Substituted imidazolidine derivatives, their preparation, their use and pharmaceutical preparations comprising them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-07-23 US disclosed
US-6344564-B1 FUNGICIDES RHONE-POULENC, INC. 2002-02-05 US disclosed
US-6018053-A Process for the preparation of chiral, nonracemic (4-aryl-2,5-dioxoimidazolidin-1-yl) acetic acids HOECHST AKTIENGESELLSCHAFT (DE) 2000-01-25 US disclosed
US-6018052-A APPLYING TO CROPS OR THEIR SEEDS TO PREVENT OR CURE FUNGAL DISEASES; STEREOSPECIFIC COMPOUND WITH IMPROVED BIOLOGICAL ACTIVITY RHONE-POULENC AGROCHIMIE (FR) 2000-01-25 US disclosed
US-6008370-A FUNGICIDAL IMIDAZOLINONE AND IMIDAZOLINETHIONE COMPOUNDS FOR USE IN PLANT PROTECTION RHONE-POULENC AGROCHIMIE (FR) 1999-12-28 US disclosed
US-6002016-A Fungicidal 2-imidazolin-5-ones and 2-imidazoline-5-thiones RHONE-POULENC AGROCHIMIE (FR) 1999-12-14 US disclosed
EP-0903353-A1 Imidazolidine derivates, their preparation and use, and pharmaceutical compositions containing them Hoechst Marion Roussel Deutschland GmbH (DE) 1999-03-24 EP disclosed
EP-0816343-A1 Process for the preparation of chiral, non-racemic (4-aryl-2,5-dioxoimidazolin-1-yl)-acetic acids HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-07 EP disclosed
US-5650519-A Optically active 5, 5-disubstituted-3-(mono- or disubstituted amino)-2-thiohydantoin intermediates to fungicidal 2-imidazolin-5-ones RHONE-POULENC AGROCHIMIE (FR) 1997-07-22 US disclosed
US-5637729-A AGRICULTURE RHONE-POULENC AGROCHIMIE (FR) 1997-06-10 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-20030125565-A1 Imidazolidine derivatives, their preparation, their use, and pharmaceutical preparations comprising them VCAM1, ITGA1, ITGA4 ALDH1A1 907/4885CYP2C9 1352/4885CACNA1F 555/4885

“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.