SCHEMBL4409807

SCHEMBL4409807

Cc1nnc(-c2ccc(N)cc2)n1-c1ccccc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MYC P01106 3/20 0.51
NR4A1 P22736 1/20 0.51
AVPR1A P37288 2/20 0.49
AVPR2 P30518 1/20 0.49
POLB P06746 1/20 0.48
AKT1 P31749 1/20 0.44
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL4408431 0.82 MYC (0.47) MYCNR4A1AVPR1AAVPR2POLB
SCHEMBL4398893 0.81 MYC (0.51) MYCNR4A1POLBALDH1A1
SCHEMBL11397192 0.72 MYC (0.54) MYCNR4A1POLBALDH1A1
SCHEMBL4405110 0.72 DDX3X (0.51) MYCNR4A1POLBALDH1A1
Phthalic Acid SCHEMBL9137413 0.72 ALDH1A1 (0.74) POLBALDH1A1
Phthalic Acid SCHEMBL27390788 0.70 AKR1C3 (0.63) MYCNR4A1POLBALDH1A1
SCHEMBL25277057 0.69 AVPR1A (0.59) AVPR1AAKT1ALDH1A1
SCHEMBL13856248 0.69 MYC (1.00) MYCNR4A1ALDH1A1
SCHEMBL11397291 0.68 MYC (0.49) MYCNR4A1POLBALDH1A1
SCHEMBL5832812 0.68 AVPR1A (0.64) AVPR1AAVPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1523475-B1 HETEROCYCLICALLY SUBSTITUTED BENZOYLUREAS, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2009-12-23 EP disclosed
CN-1304371-C Heterocyclically substituted benzoylureas, medicaments thereof and use for producing medicaments AVENTIS PHARMA GMBH (DE) 2007-03-14 CN disclosed
US-20070021474-A1 Heterocyclically Substituted Benzoylureas, Process For Their Preparation and Their Use as Pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-01-25 US disclosed
US-7138414-B2 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-11-21 US disclosed
CN-1668593-A Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals AVENTIS PHARMA GMBH (DE) 2005-09-14 CN disclosed
EP-1523475-A1 HETEROCYCLICALLY SUBSTITUTED BENZOYLUREAS, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2005-04-20 EP disclosed
US-20040152743-A1 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-08-05 US disclosed
WO-2004007455-A1 HETEROCYCLICALLY SUBSTITUTED BENZOYLUREAS, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-01-22 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 (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-20070021474-A1 Heterocyclically Substituted Benzoylureas, Process For Their Preparation and Their Use as Pharmaceuticals SLC5A2, CYP1A2, HBB MYC 2712/4885NR4A1 1533/4885AVPR1A 2509/4885
US-20040152743-A1 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals SLC5A2, CYP1B1, CYP2C19 MYC 3150/4885NR4A1 1411/4885AVPR1A 1854/4885

“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.