SCHEMBL6288838

SCHEMBL6288838

Cc1cccc(Cc2ccc(O)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.56
ESR2 Q92731 3/20 0.56
IDO1 P14902 2/20 0.50
ACHE P22303 2/20 0.50
LTA4H P09960 1/20 0.49
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
IDH1 O75874 2/20 0.47
TAAR1 Q96RJ0 2/20 0.47
GPR84 Q9NQS5 1/20 0.44
DAO P14920 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
SLC5A2 P31639 1/20 0.43
KEAP1 Q14145 1/20 0.42

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
SCHEMBL8093804 0.89 TAAR1 (0.56) IDO1ACHELTA4HSAE1UBA2
SCHEMBL18174858 0.86 ACHE (0.64) IDO1ACHEIDH1TAAR1GPR84
SCHEMBL6400232 0.85 ALOX5 (0.49) ESR1ESR2IDO1ACHELTA4H
SCHEMBL11087087 0.85 LTA4H (0.53) IDO1ACHELTA4HSAE1UBA2
SCHEMBL8085716 0.85 CALM1 (0.55) IDO1ACHELTA4HSAE1UBA2
SCHEMBL2977565 0.85 ESR1 (0.70) ESR1ESR2LTA4HIDH1KEAP1
SCHEMBL30000562 0.85 TAAR1 (0.60) IDO1ACHELTA4HTAAR1DAO
SCHEMBL29459538 0.85 TAAR1 (0.60) IDO1ACHELTA4HTAAR1DAO
SCHEMBL1263547 0.85 TAAR1 (0.60) IDO1ACHELTA4HTAAR1DAO
SCHEMBL8992941 0.84 LTA4H (0.49) ESR1ESR2IDO1ACHELTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114956933-A Marker containing isotope oxygen atom and preparation method and application thereof 清华大学 2022-08-30 CN disclosed
CN-111517902-B Aerobic oxidation system containing sulfinic acid, sulfonic acid or derivatives thereof and photo-oxidation promoting method thereof 清华大学 2022-06-14 CN disclosed
CN-111517902-A Aerobic oxidation system containing sulfinic acid, sulfonic acid or derivatives thereof and photo-oxidation promoting method thereof 清华大学 2020-08-11 CN disclosed
CN-109642018-A Epoxy resin 波音公司 2019-04-16 CN disclosed
US-9477148-B1 Polymer, method for preparing the same, and a photosensitive resin composition thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-10-25 US disclosed
US-6919419-B2 AROMATIC BLOCK POLYCARBONATE RESIN, DIPHENOL COMPOUND FOR PREPARATION OF THE POLYCARBONATE RESIN, ELECTRO-PHOTOGRAPHIC PHOTOCONDUCTOR, ELECTRO-PHOTOGRAPHIC IMAGE FORMING APPARATUS AND PROCESS, AND PROCESS CARTRIDGE RICOH COMPANY LTD. (JP) 2005-07-19 US disclosed
US-20040002574-A1 Aromatic block polycarbonate resin, diphenol compound for preparation of the polycarbonate resin, electro-photographic photoconductor, electro-photographic image forming apparatus and process, and process cartridge RICOH COMPANY, LTD. (JP) 2004-01-01 US disclosed
US-6080833-A BIS(HYDROXYALKOXYLATED) 1,1'-SPIROBIINDAN POLYCARBONATES AND POLYESTERS POLYMERS AND CURABLE COMPOUNDS SUCH AS BIS(ACRYLATED ALKOXY)SPIROBIINDANS; ALSO POLYAMIDES AND POLYIMIDES CONTAINING SPIROBIINDAN GROUPS MITSUI CHEMICALS, INC. (JP) 2000-06-27 US disclosed
US-5840454-A Aromatic polycarbonate and electrophotographic photosensitive medium using same RICOH COMPANY, LTD. (JP) 1998-11-24 US disclosed