SCHEMBL454150

SCHEMBL454150

BrCCCCCCOCCCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SIGMAR1 Q99720 3/20 0.47
IDO1 P14902 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
MAOA P21397 1/20 0.45
PLA2G4B P0C869 1/20 0.44
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL6942905 1.00 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL10477865 1.00 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL9257077 1.00 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL9258098 1.00 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL7621746 1.00 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL9574235 1.00 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL9258414 0.98 TDP1 (0.52) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL9262777 0.96 IDO1 (0.52) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL9257411 0.96 IDO1 (0.52) TDP1L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL10465461 0.96 TDP1 (0.53) TDP1L3MBTL1MEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7112701-B2 Process for the manufacture of 4-(6-bromohexyloxy)-butylbenzene BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-09-26 US claimed
EP-1483226-B1 IMPROVED METHOD FOR THE PRODUCTION OF 4-(6-BROMOHEXYLOXY) BUTYLBENZENE BOEHRINGER INGELHEIM PHARMA (DE) 2005-09-07 EP claimed
US-20050113608-A1 Process for the manufacture of 4-(6-bromohexyloxy)-butylbenzene BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-26 US claimed
US-6835857-B2 Process for the manufacture of 4-(6-bromohexyloxy)-butylbenzene BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-12-28 US claimed
EP-1483226-A1 IMPROVED METHOD FOR THE PRODUCTION OF 4-(6-BROMOHEXYLOXY) BUTYLBENZENE Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2004-12-08 EP claimed
WO-2003074458-A1 IMPROVED METHOD FOR THE PRODUCTION OF 4-(6-BROMOHEXYLOXY) BUTYLBENZENE BOEHRINGER INGELHEIM PHARMA GMBH & CO KG (DE) 2003-09-12 WO claimed
US-20030171620-A1 Process for the manufacture of 4-(6-bromohexyloxy)-butylbenzene BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-09-11 US claimed
CN-119970731-A Inhalation dry powder preparation containing salmeterol and tiotropium salt composition and preparation method thereof 南昌弘益科技有限公司 2025-05-13 CN disclosed
CN-119923380-A N-substituted phenylalkylamines and their use as therapeutic agents 亚历山大舒尔金研究所有限公司 2025-05-02 CN disclosed
EP-4543833-A1 N-SUBSTITUTED PHENYLALKYLAMINES AND THEIR USE AS THERAPEUTIC AGENTS Alexander Shulgin Research Institute, Inc. (US) 2025-04-30 EP disclosed
WO-2024006226-A1 N-SUBSTITUTED PHENYLALKYLAMINES AND THEIR USE AS THERAPEUTIC AGENTS ALEXANDER SHULGIN RESEARCH INSTITUTE, INC. (US) 2024-01-04 WO disclosed
EP-3201171-B1 METHOD OF PREPARING INTERMEDIATE OF SALMETEROL AMPHASTAR NANJING PHARMACEUTICALS INC (CN) 2020-04-15 EP disclosed
WO-2017168431-A1 PROCESS FOR THE PREPARATION OF SALMETEROL XINAFOATE DAVULURI RAMAMOHAN RAO (IN) 2017-10-05 WO disclosed
US-5225445-A Respiratory system disorders GLAXO GROUP LTD. 1993-07-06 US disclosed
US-5126375-A Asthma, chronic bronchitis GLAXO GROUP LTD. (GB) 1992-06-30 US disclosed
US-5091422-A Treating inflammatory or allergic skin disease, lowering gastric acidity GLAXO GROUP LIMITED (GB) 1992-02-25 US disclosed
US-4992474-A Adrenergic stimulants GLAXO GROUP LTD. (GB) 1991-02-12 US disclosed
US-4908386-A Pharmaceuticals GLAXO GROUP LIMITED (GB) 1990-03-13 US disclosed
US-4853381-A Ethanolamine compounds GLAXO GROUP LIMITED (GB) 1989-08-01 US disclosed
EP-0220054-A2 Ethanolamine derivatives GLAXO GROUP LIMITED (GB) 1987-04-29 EP disclosed