SCHEMBL879386

SCHEMBL879386

O=C(O)c1ccc2ccoc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.57
MRGPRX4 Q96LA9 2/20 0.55
CHRNA7 P36544 2/20 0.49
HTR3A P46098 2/20 0.49
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
HTR3D Q70Z44 1/20 0.49
HTR3C Q8WXA8 1/20 0.49
CTNNB1 P35222 2/20 0.46
WNT3A P56704 2/20 0.46
KEAP1 Q14145 1/20 0.43
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
ENPP2 Q13822 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 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
SCHEMBL31438451 1.00 HTR1B (0.57) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
Hydrochloric Acid SCHEMBL6627889 0.98 HTR1B (0.55) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL663873 0.84 CTNNB1 (0.63) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL29987426 0.84 CTNNB1 (0.63) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL103577 0.82 HTR1B (0.59) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL3793059 0.82 HTR1B (0.55) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL20618503 0.82 HTR1B (0.55) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL20617027 0.82 HTR1B (0.55) HTR1BMRGPRX4CHRNA7HTR3AHTR3E
SCHEMBL23234372 0.82 MRGPRX4 (0.48) HTR1BMRGPRX4ALDH1A1HPGDTP53
SCHEMBL20618493 0.80 HTR1B (0.49) HTR1BMRGPRX4CHRNA7HTR3AHTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120025639-A High-strength antioxidant polystyrene external wall panel 青岛物界新材料有限公司 2025-05-23 CN claimed
CN-119684712-A Environment-friendly flame-retardant engineering plastic for battery case and preparation method thereof 河北北田工程塑料有限公司 2025-03-25 CN claimed
CN-116462644-B 2- (Furan-2-ylmethylene) -4-nitrobutanoate compound and preparation method and application thereof 上海华默西医药科技有限公司 2024-11-19 CN claimed
CN-118546127-B Litasai Special synthetic method 成都天兴致远生物科技有限公司 2024-09-20 CN claimed
CN-118546127-A Litasai Special synthetic method 成都天兴致远生物科技有限公司 2024-08-27 CN claimed
CN-118420573-A Preparation method of litaxetil intermediate benzofuran-6-carboxylic acid 山东新时代药业有限公司 2024-08-02 CN claimed
CN-118420572-A Synthesis method of medicine intermediate benzofuran-6-carboxylic acid 山东新时代药业有限公司 2024-08-02 CN claimed
CN-116462645-B 2-Furan-2-ylmethylene-4-hydroxybutyrate and preparation method and application thereof 上海华默西医药科技有限公司 2024-07-05 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-117466847-A Preparation method of Neofast intermediate benzofuran-6-carboxylic acid 中国医药工业研究总院有限公司 2024-01-30 CN claimed
CN-116429936-A Method for detecting benzofuran-5-carboxylic acid in benzofuran-6-carboxylic acid 四川美域高生物医药科技有限公司 2023-07-14 CN claimed
CN-116063286-A Preparation method of ritalst and intermediate thereof 威智医药有限公司 2023-05-05 CN claimed
CN-115557939-A Method for preparing high-purity sitaxetil 广东和博制药有限公司 2023-01-03 CN claimed
CN-114689733-A Method for detecting related substances of sitagliptin or preparation thereof 扬子江药业集团南京海陵药业有限公司 2022-07-01 CN claimed
CN-112480188-A Sialyllactose glucoside and/or analog, synthetic method and application 天津科技大学 2021-03-12 CN claimed
CN-111484467-A Preparation method of sitagliptin intermediate 雅本化学股份有限公司 2020-08-04 CN claimed
WO-2019043724-A1 PROCESSES FOR THE PREPARATION OF (S)-2-(2-(BENZOFURAN-6-CARBONYL)-5,7-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE-6-CARBOXAMIDO)-3-(3-(METHYLSULFONYL)PHENYL) PROPANOIC ACID AND POLYMORPHS THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2019-03-07 WO claimed
CN-106459071-A New tricyclic quinone derivative 波士顿生物技术公司 2017-02-22 CN claimed
EP-3097095-A1 FURO-3-CARBOXAMIDE DERIVATIVES AND METHODS OF USE AbbVie Inc. (US) 2016-11-30 EP claimed
WO-2015112754-A1 FURO-3-CARBOXAMIDE DERIVATIVES AND METHODS OF USE ABBVIE INC. (US) 2015-07-30 WO claimed