SCHEMBL529103

SCHEMBL529103

[c]1cccc(C2CCCCC2)c1C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.36
TDO2 P48775 2/20 0.35
PTGS2 P35354 1/20 0.35
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
CEL P19835 2/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
HTR1D P28221 2/20 0.33
HTR1B P28222 2/20 0.33
CYP11B2 P19099 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
NUDT1 P36639 1/20 0.30
BACE1 P56817 1/20 0.30
HSP90AA1 P07900 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30

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
SCHEMBL9644212 1.00 PTGDR2 (0.36) PTGDR2TDO2PTGS2HTR1AHTR7
SCHEMBL1819043 0.98 HTR1A (0.36) PTGDR2TDO2PTGS2HTR1AHTR7
SCHEMBL7839191 0.90 HTR2C (0.45) HTR1A
SCHEMBL9586481 0.90 HTR2C (0.31)
SCHEMBL16958502 0.90 HTR2C (0.31)
SCHEMBL7837737 0.80 PTGS2 (0.38) PTGDR2PTGS2HTR1AHTR7CEL
SCHEMBL3690036 0.78 PTGDR2 (0.38) PTGDR2TDO2PTGS2CELPDCD1
SCHEMBL435126 0.78 CEL (0.40) PTGDR2TDO2PTGS2HTR1AHTR7
SCHEMBL432692 0.78 PTGS2 (0.37) PTGDR2TDO2PTGS2HTR1AHTR7
SCHEMBL436786 0.78 NPSR1 (0.33) CELCYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117551134-A Complex and preparation method and application thereof 南京佳诺霖光电科技有限公司 2024-02-13 CN claimed
WO-2024022413-A1 DIVALENT METAL COMPLEX, PREPARATION METHOD THEREFOR AND USE THEREOF, AND ORGANIC OPTOELECTRONIC DEVICE 中国石油化工股份有限公司 2024-02-01 WO claimed
CN-117466944-A Divalent metal complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2024-01-30 CN claimed
CN-114315883-B Dibenzofuran phenol IVB metal complex and preparation method thereof, catalyst system and olefin polymerization method 万华化学集团股份有限公司 2023-10-20 CN claimed
CN-116655699-A Bivalent platinum complex white phosphorus light material and device application thereof 南京佳诺霖光电科技有限公司 2023-08-29 CN claimed
CN-116574136-A Bivalent platinum complex and preparation method and application thereof 南京佳诺霖光电科技有限公司 2023-08-11 CN claimed
CN-115160472-B High insertion rate ethylene copolymer solution polymerization method 万华化学集团股份有限公司 2023-07-11 CN claimed
CN-111909196-B IVB-group-containing bimetallic complex catalyst, and preparation method and application thereof 万华化学集团股份有限公司 2023-05-26 CN claimed
CN-115991725-A Green phosphorescence bivalent platinum complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2023-04-21 CN claimed
CN-115991724-A Blue phosphorescence bivalent platinum complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2023-04-21 CN claimed
CN-111943987-A Blue-white light adjustable bivalent platinum complex and preparation method and application thereof 南京工业大学 2020-11-17 CN claimed
CN-111205273-A Bivalent platinum complex and preparation method and application thereof 南京工业大学 2020-05-29 CN claimed
CN-110615787-A Platinum complex, application thereof and organic photoelectric device comprising platinum complex 南京佳诺霖光电科技有限公司 2019-12-27 CN claimed
CN-110590856-A Platinum complex and application thereof 南京佳诺霖光电科技有限公司 2019-12-20 CN claimed
CN-110551157-A bivalent platinum complex and preparation method and application thereof NANJING JIANUOLIN OPTOELECTRONIC TECH CO LTD 2019-12-10 CN claimed
US-8048334-B2 Display panel SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-11-01 US claimed
US-20100149478-A1 DISPLAY PANEL SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-06-17 US claimed
US-7695778-B2 Liquid crystal composition and liquid crystal display apparatus using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-04-13 US claimed
US-20080273160-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY APPARATUS USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-11-06 US claimed
CN-101031595-A One-component cationic palladium pre-initiator for the latent polymerization of cycloolefins PROMERUS LLC (US) 2007-09-05 CN claimed