SCHEMBL4306370

SCHEMBL4306370

CC(C#N)Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
CA4 P22748 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
CYP2C19 P33261 1/20 0.37
CHRNB4 P30926 2/20 0.37
CHRNA3 P32297 2/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
NISCH Q9Y2I1 1/20 0.37
TSHR P16473 2/20 0.37
TRPA1 O75762 1/20 0.37

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
SCHEMBL11730852 0.83 MAOB (0.54) LMNACYP1A2CYP2C19MAOAMAOB
SCHEMBL5226607 0.80 CA1 (0.48) KDM4EMTNR1AMTNR1BLMNAGAA
SCHEMBL9921642 0.80 ALDH1A1 (0.41) KDM4ELMNATSHRALDH1A1POLB
SCHEMBL10566573 0.80
SCHEMBL8733198 0.79 POLB (0.41) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL6574277 0.78 GAA (0.44) KDM4ELMNAGAAPKMMAOA
SCHEMBL15652387 0.78 TDP1 (0.43) KDM4EGAAMAOAMAOBTSHR
SCHEMBL10572263 0.78 ALDH1A1 (0.43) LMNAGAACYP1A2CYP2C19ALDH1A1
SCHEMBL11156880 0.78 L3MBTL1 (0.45) KDM4EGAACYP1A2CYP2C9CYP2C19
SCHEMBL9918362 0.78 ALDH1A1 (0.37) LMNAGAAALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110642818-A Method for preparing benzofuran-2-formamide compound 云南师范大学 2020-01-03 CN claimed
CN-120058664-A Melatonin receptor agonist, and preparation method and application thereof 宜昌市中心人民医院(三峡大学第一临床医学院、三峡大学附属中心人民医院) 2025-05-30 CN disclosed
CN-110642818-A Method for preparing benzofuran-2-formamide compound 云南师范大学 2020-01-03 CN disclosed
CN-104160455-B Nesa coating, conductive element, composition, input unit, display device and electronic instrument 迪睿合电子材料有限公司 2017-09-22 CN disclosed
WO-2009133970-A1 CRYSTALLINE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-05 WO disclosed
JP-2003012614-A METHOD FOR PRODUCING PHENOXYPROPYLAMINES KOEI CHEM CO LTD 2003-01-15 JP disclosed
EP-0348901-B1 Process for producing optically active alfa-substituted organic acid and microorganism and enzyme used therefor ASAHI CHEMICAL IND (JP) 1995-12-06 EP disclosed
US-5294635-A Heterocyclic compounds as aldose reductase inhibitors PFIZER, INC. (US) 1994-03-15 US disclosed
US-5283193-A A biosynthesis of converting a racemic 2-substituted nitrile compound in presence of nitrilase or a mixture of hydratase and amidase ASAHI KASEI KOGYO K.K. (JP) 1994-02-01 US disclosed
EP-0530198-A1 HETEROCYCLIC COMPOUNDS AS ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1993-03-10 EP disclosed
WO-1991015491-A1 HETEROCYCLIC COMPOUNDS AS ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1991-10-17 WO disclosed
US-5039672-A Administering enzyme inhibitors to control diabetes PFIZER INC. (US) 1991-08-13 US disclosed
EP-0406661-A1 Substituted 3-aminosydnonimines, process for their preparation, and their use CASSELLA Aktiengesellschaft (DE) 1991-01-09 EP disclosed
EP-0348901-A2 Process for producing optically active alfa-substituted organic acid and microorganism and enzyme used therefor Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-01-03 EP disclosed
US-4656189-A INSECTICIDES CORNELL RESEARCH FOUNDATION, INC. (US) 1987-04-07 US disclosed
US-4587338-A SOIL REPELLENT FINISHES HOECHST AKTIENGESELLSCHAFT (DE) 1986-05-06 US disclosed
US-4108883-A DEWATERING AGENTS FOR WASTE TREATMENT AMERICAN CYANAMID COMPANY (US) 1978-08-22 US disclosed
US-4044009-A Pyrimidine alcohols and derivatives thereof AMERICAN CYANAMID COMPANY (US) 1977-08-23 US disclosed
US-4007200-A POLYMER INTERMEDIATE AMERICAN CYANAMID COMPANY (US) 1977-02-08 US disclosed
US-3936477-A Blue anthraquinoid disperse dyes, their production and use BASF AKTIENGESELLSCHAFT (DT) 1976-02-03 US disclosed