SCHEMBL375931

SCHEMBL375931

O=CNc1cc(CC(O)NCCc2ccc(NCC(O)c3ccccc3)cc2)ccc1O

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 20/20 0.74
▸ ADRB1 P08588 5/20 0.74
▸ ADRB3 P13945 3/20 0.74

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
SCHEMBL5969790 0.91 ADRB2 (0.61) ADRB2ADRB1ADRB3
SCHEMBL5968418 0.89 ADRB2 (0.59) ADRB2ADRB1ADRB3
SCHEMBL375125 0.86 ADRB2 (0.57) ADRB2ADRB1ADRB3
Milveterol SCHEMBL168972 0.85 ADRB2 (1.00) ADRB2ADRB1ADRB3
Milveterol SCHEMBL29448200 0.85 ADRB2 (1.00) ADRB2ADRB1ADRB3
Milveterol SCHEMBL265695 0.85 ADRB2 (1.00) ADRB2ADRB1ADRB3
Milveterol SCHEMBL185356 0.85 ADRB2 (1.00) ADRB2ADRB1ADRB3
Milveterol SCHEMBL4385046 0.85 ADRB2 (1.00) ADRB2ADRB1ADRB3
Milveterol SCHEMBL265694 0.85 ADRB2 (1.00) ADRB2ADRB1ADRB3
Milveterol SCHEMBL2014099 0.84 ADRB2 (0.98) ADRB2ADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1898894-A1 MRP IV INHIBITORS FOR THE TREATMENT OF RESPIRATORY DISEASES Boehringer Ingelheim International GmbH (DE) 2008-03-19 — — EP claimed
WO-2006134022-A1 MRP IV INHIBITORS FOR THE TREATMENT OF RESPIRATORY DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-12-21 — — WO claimed
EP-2651891-A1 BICYCLIC RING SYSTEM SUBSTITUTED AMIDE FUNCTIONALISED PHENOLS AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2013-10-23 — — EP disclosed
EP-2651932-A1 BICYCLIC RING SYSTEM SUBSTITUTED SULFONAMIDE FUNCTIONALISED PHENOLS AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2013-10-23 — — EP disclosed
WO-2012080456-A1 BICYCLIC RING SYSTEM SUBSTITUTED AMIDE FUNCTIONALISED PHENOLS AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-21 — — WO disclosed
WO-2012080457-A1 BICYCLIC RING SYSTEM SUBSTITUTED SULFONAMIDE FUNCTIONALISED PHENOLS AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-21 — — WO disclosed
EP-2453961-A1 HIGH-PRESSURE CHAMBER Boehringer Ingelheim International GmbH (DE) 2012-05-23 — — EP disclosed
EP-2445558-A1 INHALER Boehringer Ingelheim Vetmedica GmbH (DE) 2012-05-02 — — EP disclosed
EP-2408571-A2 RESERVOIR AND ATOMIZER Boehringer Ingelheim International GmbH (DE) 2012-01-25 — — EP disclosed
EP-2370053-A1 NOVEL POWDERED CRYSTALLINE MEDICINES FOR INHALATION Boehringer Ingelheim International GmbH (DE) 2011-10-05 — — EP disclosed
EP-2285440-A2 INHALER Boehringer Ingelheim International GmbH (DE) 2011-02-23 — — EP disclosed
WO-2007110403-A1 DOSAGE AEROSOLS FOR THE ADMINISTRATION OF PHARMACEUTICAL PREPARATIONS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-10-04 — — WO disclosed
WO-2007062721-A1 DISPENSING DEVICE, STORAGE DEVICE AND METHOD FOR DISPENSING A FORMULATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-07 — — WO disclosed
WO-2007062726-A2 DISPENSING DEVICE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-07 — — WO disclosed
WO-2007048763-A1 INHALER WITH MOUTHPIECE HAVING A MICROBIOLOGICAL PROTECTIVE FUNCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-05-03 — — WO disclosed
WO-2007045670-A1 OPTICAL SEMI-QUANTITATIVE 100 % FILLING CHECK OF PHARMACEUTICAL CAPSULES ON CAPSULE FILLING MACHINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-04-26 — — WO disclosed
WO-2007023167-A1 TRANSCORNEAL SYSTEM FOR DELIVERY OF A PHARMACEUTICAL AGENT BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-03-01 — — WO disclosed
WO-2007017438-A1 USE OF TIOTROPIUM SALTS IN THE TREATMENT OF SEVERE PERSISTANT ASTHMA BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-02-15 — — WO disclosed
WO-2006134022-A1 MRP IV INHIBITORS FOR THE TREATMENT OF RESPIRATORY DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-12-21 — — WO disclosed
WO-2006134021-A2 PROCESS FOR PREPARING TIOTROPIUM SALTS, TIOTROPIUM SALTS AS SUCH AND PHARMACEUTICAL COMPOSITIONS THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-12-21 — — WO disclosed
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