SCHEMBL4942017

SCHEMBL4942017

Nc1ccc(CC(C(=O)O)c2cn(C3CCCCC3)cn2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 15/20 1.00
CPB2 Q96IY4 7/20 0.64
CPA1 P15085 2/20 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
SCHEMBL4537473 1.00 CPB1 (1.00) CPB1CPB2CPA1
Hydrochloric Acid SCHEMBL16210424 0.99 CPB1 (0.98) CPB1CPB2CPA1
Water SCHEMBL14977064 0.99 CPB1 (0.98) CPB1CPB2CPA1
SCHEMBL14975927 0.99 CPB1 (0.98) CPB1CPB2CPA1
Water SCHEMBL16240480 0.99 CPB1 (0.98) CPB1CPB2CPA1
Water SCHEMBL16241882 0.99 CPB1 (0.98) CPB1CPB2CPA1
Hydrochloric Acid SCHEMBL5470806 0.99 CPB1 (0.98) CPB1CPB2CPA1
Water SCHEMBL16241881 0.99 CPB1 (0.98) CPB1CPB2CPA1
SCHEMBL16210645 0.99 CPB1 (0.98) CPB1CPB2CPA1
SCHEMBL4947561 0.99 CPB1 (1.00) CPB1CPB2CPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2782576-B1 SODIUM SALT OF (R)-3-[6-AMINO-PYRIDIN-3-YL]-2-(1-CYCLOHEXYL-1H-IMIDAZOL-4-YL)-PROPIONIC ACID SANOFI SA (FR) 2016-05-18 EP claimed
EP-2782575-B1 CRYSTALLINE SALTS OF R)-3-[6-AMINO-PYRIDIN-3-YL]-2-(1-CYCLOHEXYL-1H-IMIDAZOL-4-YL)-PROPIONIC ACID SANOFI SA (FR) 2016-04-20 EP claimed
US-9145385-B2 Crystalline salts of R)-3-[6-amino-pyridin-3-yl]-2-(1-cyclohexy1-1H-imidazol-4-yl)-propionic acid SANOFI (FR) 2015-09-29 US claimed
US-9102657-B2 Sodium salt of (R)-3-[6-amino-pyridin-3-yl]-2-(1-cyclohexyl-1H-imidazol-4-yl)-propionic acid SANOFI (FR) 2015-08-11 US claimed
EP-2805705-A1 Packaging with one or more administration units comprising a sodium salt of (R)-3-[6-amino-pyridin-3-yl]-2-(1-cyclohexyl-1 H-imidazol-4-yl)-propionic acid IP Gesellschaft für Management mbH (DE) 2014-11-26 EP claimed
US-20140343106-A1 Sodium Salt Of (R)-3-[6-Amino-Pyridin-3-Yl]-2-(1-Cyclohexyl-1H-Imidazol-4-Yl)-Propionic Acid SANOFI (FR) 2014-11-20 US claimed
US-20140329864-A1 Crystalline salts of R)-3-[6-amino-pyridin-3-yl]-2-(1-cyclohexyl-1H-imidazol-4-yl)-propionic acid SANOFI (FR) 2014-11-06 US claimed
US-8710232-B2 Imidazole derivatives used as TAFIa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2014-04-29 US claimed
EP-1740569-B1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2008-02-20 EP claimed
US-20070129341-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-06-07 US claimed
EP-1740569-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2007-01-10 EP claimed
WO-2005105781-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-10 WO claimed
EP-3184095-A1 ADMINISTRATION UNITS COMPRISING POLYMORPH 1 OF 2-(2-METHYLAMINO-PYRIMIDIN-4-YL]-1H-INDOLE-5-CARBOXYLIC ACID [(S)-1-CARBAMOYL-2-(PHENYL-PYRIMIDIN-2-YL-AMINO)-ETHYL]-AMIDE IP Gesellschaft für Management mbH (DE) 2017-06-28 EP disclosed
EP-3184095-A1 ADMINISTRATION UNITS COMPRISING POLYMORPH 1 OF 2-(2-METHYLAMINO-PYRIMIDIN-4-YL]-1H-INDOLE-5-CARBOXYLIC ACID [(S)-1-CARBAMOYL-2-(PHENYL-PYRIMIDIN-2-YL-AMINO)-ETHYL]-AMIDE IP Gesellschaft für Management mbH (DE) 2017-06-28 EP disclosed
EP-2805705-B1 Packaging with one or more administration units comprising a sodium salt of (R)-3-[6-amino-pyridin-3-yl]-2-(1-cyclohexyl-1 H-imidazol-4-yl)-propionic acid IP GES FÜR MAN MBH (DE) 2016-11-09 EP disclosed
EP-2782576-B1 SODIUM SALT OF (R)-3-[6-AMINO-PYRIDIN-3-YL]-2-(1-CYCLOHEXYL-1H-IMIDAZOL-4-YL)-PROPIONIC ACID SANOFI SA (FR) 2016-05-18 EP disclosed
EP-1864979-A1 Imidazole-derivatives as TAFAIa-inhibitors Sanofi-Aventis Deutschland GmbH (DE) 2007-12-12 EP disclosed
US-20070129341-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-06-07 US disclosed
EP-1740569-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2007-01-10 EP disclosed
WO-2005105781-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-10 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 (3 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-20140343106-A1 Sodium Salt Of (R)-3-[6-Amino-Pyridin-3-Yl]-2-(1-Cyclohexyl-1H-Imidazol-4-Yl)-Propionic Acid TFPI, SERPINE1, SERPINC1 CPB1 25/4885CPB2 22/4885CPA1 49/4885
US-20070129341-A1 IMIDAZOLE DERIVATIVES USED AS TAFIA INHIBITORS TFPI, TFPI2, SERPINC1 CPB1 67/4885CPB2 49/4885CPA1 154/4885
US-20140329864-A1 Crystalline salts of R)-3-[6-amino-pyridin-3-yl]-2-(1-cyclohexyl-1H-imidazol-4-yl)-propionic acid TFPI, SERPINE1, SERPINC1 CPB1 20/4885CPB2 15/4885CPA1 42/4885

“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.