SCHEMBL718147

SCHEMBL718147

O=[N+]([O-])c1cc([C@@H](O)CBr)ccc1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 4/20 0.52
CTSL P07711 4/20 0.52
POLB P06746 2/20 0.50
FFAR1 O14842 1/20 0.45
MAPT P10636 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ABCB1 P08183 1/20 0.44
PIN1 Q13526 1/20 0.43
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP19A1 P11511 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SGMS2 Q8NHU3 1/20 0.41

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
SCHEMBL29896946 1.00 CTSV (0.52) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL718146 1.00 CTSV (0.52) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL29897031 1.00 CTSV (0.52) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL2671920 1.00 CTSV (0.52) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL28809922 0.91 CTSV (0.50) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL27755531 0.91 CTSV (0.50) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL4594348 0.88 CTSV (0.52) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL5099246 0.88 CTSV (0.52) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL27468142 0.86 CTSV (0.53) CTSVCTSLPOLBFFAR1MAPT
SCHEMBL12473681 0.85 POLB (0.53) CTSVCTSLPOLBFFAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924582-A Cyclic diol modified acrylic resin, modified acrylic paint and modified acrylic finish paint 中华制漆(新丰)有限公司 2024-04-26 CN claimed
CN-111944855-B Method for synthesizing (R) -1- (4- (benzyloxy) -3-nitrophenyl) -2-bromoethanol 扬州中宝药业股份有限公司 2022-08-30 CN claimed
CN-1228448-C Process for preparing chiral medicine intermediate (R)-2-halogen-1-(substituted phenyl) ethanol TIANJIN NANKAI GUARD CO LTD (CN) 2005-11-23 CN claimed
CN-1554767-A Process for preparing chiral medicine intermediate (R)-2-halogen-1-(substituted phenyl) ethanol 天津南开戈德集团有限公司 2004-12-15 CN claimed
EP-0938467-B1 PROCESS FOR THE PREPARATION OF OPTICALLY PURE ISOMERS OF FORMOTEROL SEPRACOR INC (US) 2002-06-12 EP claimed
US-6268533-B1 REACTING 4-BENZYLOXY-3-FORMAMIDOSTYRENE OXIDE WITH AN OPTICALLY PURE 4-METHOXY-.ALPHA.-METHYL-N-(PHENYLMETHYL)BENZENEETHANAMINE FOLLOWED BY REDUCTION TO PRODUCE FORMOTEROL SEPRACOR INC. 2001-07-31 US claimed
EP-0938467-A1 PROCESS FOR THE PREPARATION OF OPTICALLY PURE ISOMERS OF FORMOTEROL SEPRACOR, INC. (US) 1999-09-01 EP claimed
WO-1998021175-A1 PROCESS FOR THE PREPARATION OF OPTICALLY PURE ISOMERS OF FORMOTEROL SEPRACOR, INC. (US) 1998-05-22 WO claimed
CN-117924582-A Cyclic diol modified acrylic resin, modified acrylic paint and modified acrylic finish paint 中华制漆(新丰)有限公司 2024-04-26 CN disclosed
CN-110627673-B Preparation method of formoterol key intermediate 上海天慈中商药业有限公司 2023-04-07 CN disclosed
CN-111944855-B Method for synthesizing (R) -1- (4- (benzyloxy) -3-nitrophenyl) -2-bromoethanol 扬州中宝药业股份有限公司 2022-08-30 CN disclosed
CN-111944855-B Method for synthesizing (R) -1- (4- (benzyloxy) -3-nitrophenyl) -2-bromoethanol 扬州中宝药业股份有限公司 2022-08-30 CN disclosed
CN-111944855-B Method for synthesizing (R) -1- (4- (benzyloxy) -3-nitrophenyl) -2-bromoethanol 扬州中宝药业股份有限公司 2022-08-30 CN disclosed
CN-107652274-B Pentaerythritol immobilized (S) or (R) -diphenyl prolinol, and preparation method and application thereof 石家庄学院 2020-07-21 CN disclosed
US-6071971-A FOR TREATING PULMONARY DISORDERS SEPRACOR INC. (US) 2000-06-06 US disclosed
EP-0997458-A1 NOVEL TRICYCLIC COMPOUNDS HAVING SATURATED RINGS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-05-03 EP disclosed
US-6037362-A CARBAZOLE DERIVATIVES; DEPROTECTING, AMINATION; ANTILIPEMIC AND ANTIDIABETIC AGENTS; B-ADRENALINE RECEPTOR AGONISTS; DIETETICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2000-03-14 US disclosed
US-5965622-A BRONCHODILATORS; HIGHLY SELECTIVE BETA 2-ADRENERGIC RECEPTOR AGONIST; RESPIRATORY DISORDERS, E.G. ASTHMA, BRONCHITIS; REDUCTION OF A PROTECTED NITRO DERIVATIVE; STEREOSPECIFIC SEPRACOR INC. (US) 1999-10-12 US disclosed
CN-1209119-A Novel tricyclic compounds and pharmaceutical compositions containing them ASAHI CHEMICAL IND (JP) 1999-02-24 CN disclosed
EP-0882707-A1 NOVEL TRICYCLIC COMPOUNDS AND DRUG COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1998-12-09 EP disclosed