SCHEMBL67004

SCHEMBL67004

Brc1ccc(N(c2ccc(Br)cc2)c2ccc(Br)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.57
CA2 P00918 3/20 0.43
CA1 P00915 2/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 6/20 0.42
MAPK1 P28482 3/20 0.42
ALOX15 P16050 2/20 0.42
TDP1 Q9NUW8 3/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
TAAR1 Q96RJ0 2/20 0.35
HTR2A P28223 1/20 0.33

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
SCHEMBL23714869 1.00 CYP2A6 (0.57) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL22502466 0.97 CYP2A6 (0.53) CYP2A6CA2CA1TSHRALDH1A1
Fluoride SCHEMBL31365993 0.97 CYP2A6 (0.53) CYP2A6CA2CA1TSHRALDH1A1
Hydrochloric Acid SCHEMBL1034657 0.94 CYP2A6 (0.50) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL12781545 0.91 ALDH1A1 (0.52) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL3794654 0.91 ALDH1A1 (0.52) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL24576 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL7033150 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL460304 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL15687666 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1

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 1236 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120193287-A Method for synthesizing 1, 6-dioxygen olefin compound by electrocatalytic means 南京工业大学 2025-06-24 CN claimed
CN-120081878-A Polynuclear metallocene complex, preparation method thereof, catalyst composition and application thereof 中国石油化工股份有限公司 2025-06-03 CN claimed
CN-119979053-A Ultraviolet conversion adhesive film based on quantum dots, and preparation method and application thereof 伽米(天津)新材料有限公司 2025-05-13 CN claimed
CN-119875178-A Graphene conductive film and preparation method thereof 上海精厚电子科技有限公司 2025-04-25 CN claimed
CN-119823355-A Conductive polymer material, preparation method and application 北京大学深圳研究生院 2025-04-15 CN claimed
CN-119409966-A Imidazolium salt polymer adsorbent and preparation method and application thereof 商洛学院 2025-02-11 CN claimed
CN-119409944-A Method for storing and delivering electron special gas by adopting fluorine-containing porous organic polymer 浙江大学 2025-02-11 CN claimed
CN-119161669-A Reinforced and toughened polypropylene board and preparation method thereof 江苏宏佳华新材料科技有限公司 2024-12-20 CN claimed
CN-118772438-B MOF material based on trifluoromethyl tricarboxylic acid, preparation method and SO2Separation application 德州学院 2024-11-22 CN claimed
CN-116180454-B Fiber catalytic membrane based on conjugated microporous polymer and preparation method and application thereof 东华大学 2024-10-18 CN claimed
US-6232494-B1 CATALYTIC OXIDATION MONSANTO COMPANY 2001-05-15 US claimed
EP-0617720-B1 POLYMERIZABLE COMPOSITIONS CONTAINING OLEFIN METATHESIS CATALYSTS AND COCATALYSTS, AND METHODS OF USE THEREFOR MINNESOTA MINING & MFG (US) 2001-04-18 EP claimed
EP-1062221-A1 PROCESS FOR MAKING GLYPHOSATE BY OXIDIZING N-SUBSTITUTED GLYPHOSATES MONSANTO COMPANY (US) 2000-12-27 EP claimed
WO-2000009517-A2 PROCESS FOR THE PREPARATION OF N-(PHOSPHONOMETHYL)GLYCINE BY OXIDIZING N-SUBSTITUTED N-(PHOSPHONOMETHYL)GLYCINE MONSANTO COMPANY (US) 2000-02-24 WO claimed
US-6005140-A USING A NOBLE METAL OXIDATION CATALYST MONSANTO COMPANY (US) 1999-12-21 US claimed
WO-1999041260-A1 PROCESS FOR MAKING GLYPHOSATE BY OXIDIZING N-SUBSTITUTED GLYPHOSATES MONSANTO COMPANY (US) 1999-08-19 WO claimed
US-5834080-A Controllably conductive polymer compositions for development systems XEROX CORPORATION (US) 1998-11-10 US claimed
US-5663030-A A PHENYL OR NORBORNANE DERIVATIVE AS AN ADDITIVE TO REDUCE HEAT AND ENERGY REQUIRED TO FUSE THE TONER AND TO REDUCE JAMMING OF THE EQUIPMENT XEROX CORPORATION (US) 1997-09-02 US claimed
US-4956014-A A TERTIARY AMINE PROMOTER FOR REDUCING A COPPER SALT NIPPONDENSO CO., LTD. (JP) 1990-09-11 US claimed
US-4814009-A TERT-AMINE ACCELERATOR NIPPONDENSO CO., LTD. (JP) 1989-03-21 US claimed