SCHEMBL2120180

SCHEMBL2120180

O=Cc1cc(Br)cc(Br)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 7/20 1.00
CYP3A4 P08684 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
GABRA1 P14867 1/20 0.50
GABRB1 P18505 1/20 0.50
GABRA2 P47869 1/20 0.50
GABRB2 P47870 1/20 0.50
AKR1C4 P17516 1/20 0.47
AKR1C3 P42330 1/20 0.47
AKR1C2 P52895 1/20 0.47
AKR1C1 Q04828 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ACHE P22303 1/20 0.46
CA9 Q16790 1/20 0.46
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
MAPT P10636 4/20 0.45

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
SCHEMBL29371317 1.00 ERN1 (1.00) ERN1CYP3A4TSHRTDP1GABRA1
Alcohol SCHEMBL28685702 0.90 ERN1 (0.81) ERN1CYP3A4TSHRTDP1GABRA1
SCHEMBL544809 0.88 ERN1 (0.78) ERN1CYP3A4TSHRTDP1
SCHEMBL29285288 0.86 ERN1 (0.73) ERN1CYP3A4TSHRTDP1GABRA1
Glycine SCHEMBL29175396 0.86 ERN1 (0.73) ERN1CYP3A4TSHRTDP1AKR1C4
SCHEMBL27923095 0.86 ERN1 (0.73) ERN1CYP3A4TSHRTDP1AKR1C4
SCHEMBL29285286 0.83 ERN1 (0.69) ERN1CYP3A4TSHRTDP1CA12
SCHEMBL30689083 0.82 ERN1 (0.69) ERN1CYP3A4TSHRTDP1
SCHEMBL4062201 0.82 ERN1 (0.69) ERN1CYP3A4TSHRTDP1
SCHEMBL9189245 0.82 ERN1 (0.69) ERN1CYP3A4TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437252-B Method for removing residual nickel in styrene-conjugated diene copolymer catalytic hydrogenation glue solution 中国石油化工股份有限公司 2024-07-05 CN claimed
CN-117820329-A Spiropyran derivative and synthetic method and application thereof 陕西科技大学 2024-04-05 CN claimed
CN-117586433-A N, N, N-trimethyl chitosan quaternary ammonium salt containing glycine Schiff base and preparation and application thereof 中国科学院烟台海岸带研究所 2024-02-23 CN claimed
CN-117486688-A 14 C labelHydroxy and methoxy polybrominated diphenyl ethers and synthesis method thereof 中国药科大学 2024-02-02 CN claimed
CN-117209741-A Preparation method of Schiff base catalyst and preparation method of polyglycolic acid 中国科学院长春应用化学研究所 2023-12-12 CN claimed
CN-113999393-B Polydopamine Schiff base-copper complex catalyst and preparation method and application thereof 南京大学 2022-09-02 CN claimed
CN-114437252-A Method for removing residual nickel in styrene-conjugated diene copolymer catalytic hydrogenation glue solution 中国石油化工股份有限公司 2022-05-06 CN claimed
CN-113999393-A Polydopamine Schiff base-copper complex catalyst and preparation method and application thereof 南京大学 2022-02-01 CN claimed
CN-108212217-B Catalyst for degrading chlorophenol pollutants, preparation method and application 南京大学 2020-09-29 CN claimed
CN-110066241-A A kind of Schiff base complex of zinc and its preparation method and application 陕西理工大学 2019-07-30 CN claimed
CN-101468956-B Schiff base compound and synthesizing method thereof BYD CO LTD 2012-09-26 CN claimed
CN-101468956-A Schiff base compound and synthesizing method thereof BYD CO LTD (CN) 2009-07-01 CN claimed
US-20060084176-A1 Detection of uronium salts YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2006-04-20 US claimed
US-6797745-B1 Hot melt inks containing styrene or terpene polymers XEROX CORPORATION 2004-09-28 US claimed
US-6780900-B1 ALDEHYDE COPOLYMER INK VEHICLE, A NONPOLYMERIC ALDEHYDE VISCOSITY MODIFIER, COLORANT, AN OPTIONAL CONDUCTIVITY ENHANCING AGENT, AN OPTIONAL ANTIOXIDANT, AND AN OPTIONAL UV ABSORBER XEROX CORPORATION 2004-08-24 US claimed
US-4661636-A 6-sulfoxyphenol derivatives, their preparation and their use as cytoprotective agents HOECHST AKTIENGESELLSCHAFT (DE) 1987-04-28 US claimed
EP-0046270-B1 NOVEL DERIVATIVES OF BIO-AFFECTING PHENOLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITION CONTAINING THEM INTERx RESEARCH CORPORATION (US) 1986-05-21 EP claimed
EP-0135860-A2 Derivatives of 6-sulfoxyphenol, their preparation and their use as cytoprotectors; use of derivatives of salicylaldehyde as cytoprotectors HOECHST AKTIENGESELLSCHAFT (DE) 1985-04-03 EP claimed
EP-0046270-A1 Novel derivatives of bio-affecting phenolic compounds and pharmaceutical composition containing them INTERx RESEARCH CORPORATION (US) 1982-02-24 EP claimed
US-4029690-A WITH 2,5-DIMETHYL-2,4-HEXADIENE AND AN ALKYL DIAZOACETATE WITH A COPPER COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-06-14 US claimed