SCHEMBL28007657

SCHEMBL28007657

O=CC(=O)C1Cc2cccc3cccc1c23

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 10/20 0.47
MTNR1B P49286 10/20 0.47
KDM4E B2RXH2 1/20 0.38
OPRL1 P41146 4/20 0.37
OPRM1 P35372 3/20 0.37
OPRD1 P41143 2/20 0.37
OPRK1 P41145 2/20 0.37
CYP3A4 P08684 1/20 0.33
TSHR P16473 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
SCHEMBL9240061 0.83 MTNR1A (0.51) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL5380872 0.81 MTNR1A (0.50) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL30066901 0.81 MTNR1A (0.50) MTNR1AMTNR1BKDM4EOPRL1OPRM1
Formic Acid SCHEMBL28598514 0.81 MTNR1A (0.45) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL28599443 0.80 MTNR1A (0.49) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL28138447 0.80 MTNR1A (0.49) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL5370015 0.80 MTNR1A (0.56) MTNR1AMTNR1BKDM4EOPRL1OPRM1
Hydrochloric Acid SCHEMBL8440245 0.79 MTNR1A (0.48) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL11146721 0.77 MTNR1A (0.47) MTNR1AMTNR1BKDM4EOPRL1OPRM1
SCHEMBL9517871 0.76 MTNR1A (0.52) MTNR1AMTNR1B

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104387424-B The methyl substituted difluorophenyl Branched polyethylene preparation method of two (phenyl) of one kind and vinyl polymerization 中国科学院大学 2017-12-12 CN claimed
CN-104387424-A Preparation method of 2-(phenyl) methyl-substituted fluorobenzene acenaphthene diimine nickel complex and vinyl polymerization UNIV CAS 2015-03-04 CN claimed
CN-115894870-A Polymer and polymer nanoparticle of benzo-bis-quinoxaline receptor for photothermal therapy, and preparation and application thereof 华南理工大学 2023-04-04 CN disclosed
CN-113583002-A Synthetic method of glycoluril analogue 兴义民族师范学院 2021-11-02 CN disclosed
CN-108864334-A Double-core(Alpha-diimine)Nickel/palladium alkene catalyst, preparation method and application 浙江大学 2018-11-23 CN disclosed
CN-108864343-A A kind of double-core (alpha-diimine) nickel/palladium alkene catalyst, preparation and application 浙江大学 2018-11-23 CN disclosed
CN-108864342-A A kind of double-core (alpha-diimine) nickel/palladium alkene catalyst and its preparation and application 浙江大学 2018-11-23 CN disclosed
CN-104387424-B The methyl substituted difluorophenyl Branched polyethylene preparation method of two (phenyl) of one kind and vinyl polymerization 中国科学院大学 2017-12-12 CN disclosed
CN-107406350-A NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 株式会社LG化学 2017-11-28 CN disclosed
CN-104387424-A Preparation method of 2-(phenyl) methyl-substituted fluorobenzene acenaphthene diimine nickel complex and vinyl polymerization UNIV CAS 2015-03-04 CN disclosed