SCHEMBL4380000

SCHEMBL4380000

C[C@]1(c2ccncc2)NC(=O)NC1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 1/20 0.49
TNKS O95271 1/20 0.44
MMP13 P45452 2/20 0.43
MMP8 P22894 1/20 0.43
MMP14 P50281 1/20 0.43
AR P10275 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CYP19A1 P11511 5/20 0.39
CACNA1F O60840 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
SCN1A P35498 1/20 0.38
SCN4A P35499 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
CACNA1D Q01668 1/20 0.38

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
SCHEMBL4380003 1.00 MEN1 (0.49) MEN1KMT2ALMNATNKSMMP13
SCHEMBL1092035 1.00 MEN1 (0.49) MEN1KMT2ALMNATNKSMMP13
SCHEMBL4384456 0.82 ALDH1A1 (0.59) MEN1KMT2ALMNATNKSALDH1A1
SCHEMBL4384462 0.82 ALDH1A1 (0.59) MEN1KMT2ALMNATNKSALDH1A1
SCHEMBL542865 0.82 ALDH1A1 (0.59) MEN1KMT2ALMNATNKSALDH1A1
SCHEMBL20134878 0.80 LMNA (0.53) MEN1KMT2ALMNATNKSALDH1A1
SCHEMBL6282916 0.80 ALDH1A1 (0.57) MEN1KMT2ALMNATNKSALDH1A1
SCHEMBL542561 0.80 LMNA (0.53) MEN1KMT2ALMNATNKSALDH1A1
SCHEMBL17054772 0.78 MEN1 (0.55) MEN1KMT2ALMNATNKSCYP19A1
SCHEMBL6135313 0.78 LMNA (0.51) MEN1KMT2ALMNATNKSMMP13

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 5 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
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
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

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 MEN1 4123/4885KMT2A 1175/4885LMNA 1133/4885

“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.