SCHEMBL4590484

SCHEMBL4590484

O=CC1Cc2cccc3cccc1c23

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 9/20 0.44
MTNR1B P49286 9/20 0.44
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
OPRM1 P35372 4/20 0.34
OPRK1 P41145 4/20 0.34
OPRL1 P41146 4/20 0.34
OPRD1 P41143 3/20 0.34

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
SCHEMBL31213979 1.00 MTNR1A (0.44) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL28144519 0.81 MTNR1A (0.41) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL2701226 0.81 MTNR1A (0.41) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL28202807 0.81 MTNR1A (0.41) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL12719040 0.78 KDM1A (0.44)
SCHEMBL27999307 0.77 MTNR1A (0.39) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL7536358 0.75 KDM1A (0.38) MTNR1AMTNR1BALDH1A1OPRM1OPRK1
SCHEMBL29014216 0.75 PDK2 (0.35) MTNR1AOPRM1OPRK1OPRL1
SCHEMBL27778175 0.75 TYMS (0.36) TSHRKDM4EALDH1A1HPGDOPRM1
SCHEMBL28783256 0.75 MEN1 (0.33) MTNR1AMTNR1BCYP3A4TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104803881-B Compound (2Z)-2-((4-bromophenyl) hydrazono-) acenaphthene-1-ketone and preparation method thereof and application NANJING UNIVERSITY OF INFORMATION SCIENCE AND TECHNOLOGY (CN) 2016-04-20 CN claimed
CN-103130211-B The preparation method of Graphene XIDIAN UNIVERSITY (CN) 2015-10-21 CN claimed
CN-104803881-A Compound (2Z)-2-((4-bromophenyl) hydrazono) acenaphthene-1-ketone as well as preparation method and application thereof UNIV NANJING INF SCI & TECH 2015-07-29 CN claimed
CN-103130211-A Preparation method of graphene UNIV XIDIAN 2013-06-05 CN claimed
CN-113105475-B Inhibitors of bruton's tyrosine kinase and methods of use thereof 詹森药业有限公司 2022-09-09 CN disclosed
CN-113105475-A Inhibitors of bruton's tyrosine kinase and methods of use thereof 詹森药业有限公司 2021-07-13 CN disclosed
CN-107533291-B Compound, resist composition, and resist pattern formation method using same 三菱瓦斯化学株式会社 2021-06-11 CN disclosed
CN-106957217-B Polyhydric phenol compound for resist composition 三菱瓦斯化学株式会社 2020-07-24 CN disclosed
CN-106995451-B A kind of response type cysteine probe and preparation method thereof 许昌学院 2019-03-15 CN disclosed
CN-107141303-B A kind of response type sulfhydryl compound probe and preparation method thereof 许昌学院 2019-03-15 CN disclosed
CN-109071563-A Inhibitors of bruton's tyrosine kinase and methods of use thereof 詹森药业有限公司 2018-12-21 CN disclosed
CN-107090191-B A kind of rhodamine fluorescent dyes and preparation method thereof 许昌学院 2018-12-11 CN disclosed
EP-0967007-A2 Method for microencapsulating a solid substance SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-29 EP disclosed
CN-1235866-A Method for microencapsulating solid substance SUMITOMO CHEMICAL CO (JP) 1999-11-24 CN disclosed
CN-1191862-A 8-substituted-1,3,8-triaza-spiro [4,5] decan-4-on derivatives HOFFMANN LA ROCHE (CH) 1998-09-02 CN disclosed
US-5254522-A Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1993-10-19 US disclosed
EP-0196160-B1 THERMOSETTING COMPOSITION, METHOD OF PRODUCING A FUSIBLE THERMOSETTING RESIN USING THIS COMPOSITION, AND PROCESS FOR THE PRODUCTION OF A CONDENSED, POLYNUCLEAR AROMATIC HYDROCARBON RESIN USING ONE OF THE COMPOSITIONS Otani, Sugio (JP) 1992-05-20 EP disclosed
EP-0453395-A1 Pressure sensitive recording material CIBA-GEIGY AG (CH) 1991-10-23 EP disclosed
US-4758653-A Thermosetting composition, method of producing fusible thermosetting resin using same, and process for the production of condensed, polynuclear aromatic hydrocarbon resin using same FUJI STANDARD RESEARCH INC. (JP) 1988-07-19 US disclosed
EP-0196160-A2 Thermosetting composition, method of producing a fusible thermosetting resin using this composition, and process for the production of a condensed, polynuclear aromatic hydrocarbon resin using one of the compositions Otani, Sugio (JP) 1986-10-01 EP disclosed