SCHEMBL80789

SCHEMBL80789

BrCCCCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.67
MAOA P21397 1/20 0.58
MAOB P27338 2/20 0.56
SIGMAR1 Q99720 7/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
HTR2A P28223 1/20 0.50
TRPA1 O75762 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
CHRM2 P08172 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
CHRM1 P11229 1/20 0.50
DRD1 P21728 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
ADRA1A P35348 1/20 0.50
OPRM1 P35372 1/20 0.50

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
SCHEMBL28792071 1.00 TDP1 (0.67) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL7563162 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL2162933 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL1773132 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL7612611 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL2404356 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL79441 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL11806608 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL17027772 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1
SCHEMBL854090 0.97 TDP1 (0.64) TDP1MAOAMAOBSIGMAR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118791367-B Directional high-value method for waste polyester product 浙江大学长三角智慧绿洲创新中心 2025-02-25 CN claimed
CN-116354962-B 12-Nitrogen substituted matric acid ester derivative, preparation method and application thereof 广西大学 2025-01-07 CN claimed
CN-118791367-A Directional high-value method for waste polyester product 浙江大学长三角智慧绿洲创新中心 2024-10-18 CN claimed
CN-118206417-A Cobalt catalytic dehalogenation deuteration method 中国科学院大连化学物理研究所 2024-06-18 CN claimed
CN-117779469-A Construction method of host and guest of photodynamic/quaternary ammonium salt/boric acid antibacterial composite PET fiber coating 浙江豪欣纺织有限公司 2024-03-29 CN claimed
CN-114874139-B Synthesis method of 1-benzyl or allyl 3, 4-dihydroisoquinoline 新疆大学 2024-02-06 CN claimed
CN-116354962-A 12-nitrogen substituted matric acid ester derivative, preparation method and application thereof 广西大学 2023-06-30 CN claimed
CN-113264850-A Synthetic method of nootropic ketonic A 安徽农业大学 2021-08-17 CN claimed
CN-106398080-B A kind of ammonium cross-linking type block copolymer/graphene composite material and preparation method thereof 北京化工大学 2018-12-04 CN claimed
CN-108911948-A A kind of synthetic method of the bromo- 4- phenyl butane of intermediate 1- 杨程飞扬 2018-11-30 CN claimed
CN-101450943-A Method for synthesizing drug pranlukast from tetrahydrofuran path UNIV HEBEI SCIENCE & TECH (CN) 2009-06-10 CN claimed
US-6037509-A Process for producing 1-bromo-4-phenylbutane SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-03-14 US claimed
EP-0848693-A4 ISOMERIZATION OF BISPHENOLS DOW CHEMICAL CO (US) 1999-03-17 EP claimed
CN-1200105-A Isomerization of bisphenols DOW CHEMICAL CO (US) 1998-11-25 CN claimed
EP-0848693-A1 ISOMERIZATION OF BISPHENOLS THE DOW CHEMICAL COMPANY (US) 1998-06-24 EP claimed
WO-1997008122-A1 ISOMERIZATION OF BISPHENOLS THE DOW CHEMICAL COMPANY (US) 1997-03-06 WO claimed
CN-1137788-A Process for making polyphenols from ketones or aldehydes and phenols DOW CHEMICAL CO (US) 1996-12-11 CN claimed
EP-0725771-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-08-14 EP claimed
WO-1996006819-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-03-07 WO claimed
US-5380910-A Dehalogeno coupling IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-01-10 US claimed