SCHEMBL1804115

SCHEMBL1804115

O=C(O)C(Br)=Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.61
AKR1C1 Q04828 1/20 0.54
TBXAS1 P24557 2/20 0.51
HTT P42858 2/20 0.50
FBP1 P09467 2/20 0.50
CYP2C9 P11712 2/20 0.48
CYP3A4 P08684 1/20 0.48
TP53 P04637 1/20 0.47
ALDH1A1 P00352 3/20 0.45
TSHR P16473 1/20 0.45
RECQL P46063 2/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
HDAC3 O15379 1/20 0.43
TNKS O95271 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43

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
SCHEMBL1481710 1.00 AKR1C3 (0.61) AKR1C3AKR1C1TBXAS1HTTFBP1
SCHEMBL1804114 1.00 AKR1C3 (0.61) AKR1C3AKR1C1TBXAS1HTTFBP1
SCHEMBL13997261 0.85 AKR1C3 (0.52) AKR1C3AKR1C1HTTFBP1CYP2C9
SCHEMBL10932008 0.82 AKR1C3 (0.63) AKR1C3AKR1C1HTTFBP1ALDH1A1
SCHEMBL981422 0.80 AKR1C1 (0.53) AKR1C3AKR1C1HTTFBP1ALDH1A1
SCHEMBL981421 0.80 AKR1C1 (0.53) AKR1C3AKR1C1HTTFBP1ALDH1A1
SCHEMBL9247714 0.80 TBXAS1 (0.47) AKR1C3AKR1C1TBXAS1CYP3A4TP53
SCHEMBL11044925 0.80 KDM4E (0.58) AKR1C3FBP1MEN1KMT2AKDM4E
SCHEMBL11044928 0.80 KDM4E (0.58) AKR1C3FBP1MEN1KMT2AKDM4E
SCHEMBL22502356 0.77 TBXAS1 (0.56) AKR1C3TBXAS1CYP2C9CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116589458-A Co-crystals of berberine-substituted cinnamic acid and application thereof in preparation of medicines for treating colonitis 安徽中医药大学 2023-08-15 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
EP-0095932-B1 THE USE OF A PARTICULATE POLYMER AS A CARRIER FOR BIOLOGICAL SUBSTANCES AND THE LIKE AND SUCH SUBSTANCES SUPPORTED ON THE CARRIER JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1986-08-06 EP claimed
US-4065428-A Polymethylmethacrylate based molding compositions MONSANTO COMPANY (US) 1977-12-27 US claimed
US-12298709-B2 Toner and method for producing toner CANON KABUSHIKI KAISHA (JP) 2025-05-13 US disclosed
CN-116589458-B Co-crystals of berberine-substituted cinnamic acid and application thereof in preparation of medicines for treating colonitis 安徽中医药大学 2025-02-11 CN disclosed
CN-116589458-A Co-crystals of berberine-substituted cinnamic acid and application thereof in preparation of medicines for treating colonitis 安徽中医药大学 2023-08-15 CN disclosed
CN-116355011-A Cinnamic acid derivative, preparation method and application thereof, and hydromagnesite composite powder, preparation method and application thereof 江西广源新材料有限公司 2023-06-30 CN disclosed
EP-3600806-B1 TRANSPARENT WOOD AND A METHOD FOR ITS PREPARATION CELLUTECH AB (SE) 2023-06-07 EP disclosed
US-11602872-B2 Transparent wood and a method for its preparation CELLUTECH AB (SE) 2023-03-14 US disclosed
CN-114384774-A Toner and method for producing toner 佳能株式会社 2022-04-22 CN disclosed
EP-0170524-B1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1992-07-15 EP disclosed
US-5122580-A Polymerizing a mixture of unsaturated monomers in a tube by heating progressively from one end to the other LUMENYTE INTERNATIONAL CORPORATION (US) 1992-06-16 US disclosed
EP-0269821-B1 OPTICAL WAVEGUIDE HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-01 EP disclosed
US-4968698-A FUNGICIDES, ANTIPROTOZOA AGENTS BURROUGHS WELLCOME CO. (US) 1990-11-06 US disclosed
EP-0269821-A1 Optical waveguide HOECHST AKTIENGESELLSCHAFT (DE) 1988-06-08 EP disclosed
EP-0267459-A1 Transparent polymers HOECHST AKTIENGESELLSCHAFT (DE) 1988-05-18 EP disclosed
EP-0170524-A2 Nitrogen containing heterocyclic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1986-02-05 EP disclosed