SCHEMBL1469977

SCHEMBL1469977

O=C(O)C=Cc1ccc(Br)cc1F

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.67
GPR183 P32249 1/20 0.50
EIF2AK2 P19525 1/20 0.47
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A1 P68400 1/20 0.47
DGAT1 O75907 1/20 0.44
TDO2 P48775 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
NFKB1 P19838 1/20 0.42
CA4 P22748 1/20 0.42
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 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
SCHEMBL1469976 1.00 MIF (0.67) MIFGPR183EIF2AK2CSNK2A2CSNK2B
Hydrochloric Acid SCHEMBL6818301 0.98 MIF (0.65) MIFGPR183EIF2AK2CSNK2A2CSNK2B
SCHEMBL17157980 0.86 MIF (0.50) MIFGPR183DGAT1SMN1; SMN2NPC1
SCHEMBL17157978 0.86 MIF (0.50) MIFGPR183DGAT1SMN1; SMN2NPC1
SCHEMBL1481645 0.86 MIF (0.53) MIFGPR183EIF2AK2CSNK2A2CSNK2B
SCHEMBL1481643 0.86 MIF (0.53) MIFGPR183EIF2AK2CSNK2A2CSNK2B
SCHEMBL7480804 0.84 DGAT1 (0.51) MIFGPR183DGAT1SMN1; SMN2NPC1
SCHEMBL22397868 0.84 DGAT1 (0.51) MIFGPR183DGAT1SMN1; SMN2NPC1
SCHEMBL6818296 0.84 GPR183 (0.49) MIFGPR183DGAT1SMN1; SMN2NPC1
SCHEMBL30632952 0.84 DGAT1 (0.51) MIFGPR183DGAT1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113234027-B 4, 6-bis (aryloxy) pyrimidine derivative and synthesis method and application thereof 山东大学 2022-06-03 CN claimed
CN-113234027-A 4, 6-bis (aryloxy) pyrimidine derivative and synthesis method and application thereof 山东大学 2021-08-10 CN claimed
EP-1747059-A1 PERVAPORATION COMPOSITE MEMBRANES McMaster University (CA) 2007-01-31 EP claimed
US-20060000778-A1 high-performance membrane designed for the selective removal of a polar fluid (water) from less polar fluids (organic solvents), by a pervaporation using a composite membrane contaiing ultrafiltration membrane as support ( e.g. cellulose acetate) and a crosslinked copolymer of anionic, cationic monomers MCMASTER UNIVERSITY (CA) 2006-01-05 US claimed
WO-2005102503-A1 PERVAPORATION COMPOSITE MEMBRANES MCMASTER UNIVERSITY (CA) 2005-11-03 WO claimed
CN-113234027-B 4, 6-bis (aryloxy) pyrimidine derivative and synthesis method and application thereof 山东大学 2022-06-03 CN disclosed
CN-113234027-A 4, 6-bis (aryloxy) pyrimidine derivative and synthesis method and application thereof 山东大学 2021-08-10 CN disclosed
CN-105367495-B Piperlongumine containing seven membered lactams rings is similar to object and its preparation and application 中国人民解放军第二军医大学 2019-07-23 CN disclosed
EP-2828243-B1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF SERAGON PHARMACEUTICALS INC (US) 2018-10-17 EP disclosed
US-9499538-B2 Estrogen receptor modulators and uses thereof SERAGON PHARMACEUTICALS, INC. (US) 2016-11-22 US disclosed
US-9499467-B2 Ortho-fluoro substituted compounds for the treatment of metabolic diseases CALDAN THERAPEUTICS LIMITED (GB) 2016-11-22 US disclosed
EP-2226192-B1 DRYING SUBSTANCES, PREPARATION AND USE THEREOF ORIDION MEDICAL 1987 LTD (IL) 2016-08-31 EP disclosed
US-6239152-B1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PHARMACIA & UPJOHN COMPANY 2001-05-29 US disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
EP-1049682-A1 OXAZOLIDINONE COMBINATORIAL LIBRARIES, COMPOSITIONS AND METHODS OF PREPARATION Versicor, Inc. (US) 2000-11-08 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
WO-1999037630-A1 OXAZOLIDINONE COMBINATORIAL LIBRARIES, COMPOSITIONS AND METHODS OF PREPARATION VERSICOR, INC. (US) 1999-07-29 WO disclosed
US-5489592-A ALDOSE REDUCTASE INHIBITORS FOR TREATMENT OF DIABETES-RELATED DISORDERS LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1996-02-06 US disclosed
EP-0607344-A1 3,4-DIHYDRO-4-OXO-3-(PROP-2-ENYL)-1-PHTALAZINEACETIC ACIDS AND DERIVATIVES, PREPARATIONS THEREOF AND DRUGS CONTAINING SAME LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1994-07-27 EP disclosed
WO-1993007109-A1 3,4-DIHYDRO-4-OXO-3-(PROP-2-ENYL)-1-PHTALAZINEACETIC ACIDS AND DERIVATIVES, PREPARATIONS THEREOF AND DRUGS CONTAINING SAME LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1993-04-15 WO disclosed