SCHEMBL40528

SCHEMBL40528

CC(C)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.58
CYP1A2 P05177 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CHRNB2 P17787 1/20 0.50
CHRNA4 P43681 1/20 0.50
CYP3A4 P08684 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PTPN5 P54829 2/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
ACP3 P15309 1/20 0.46
MAPT P10636 2/20 0.46
RAB9A P51151 1/20 0.46
PAX8 Q06710 1/20 0.46
NOD2 Q9HC29 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP17A1 P05093 1/20 0.46

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
SCHEMBL20833031 1.00 PTGS2 (0.58) PTGS2CYP1A2ALDH1A1CHRNB2CHRNA4
Methane SCHEMBL27572717 0.97 PTGS2 (0.56) PTGS2CYP1A2ALDH1A1CHRNB2CHRNA4
Water SCHEMBL11022921 0.97 PTGS2 (0.56) PTGS2CYP1A2ALDH1A1CHRNB2CHRNA4
Methyl Alcohol SCHEMBL10448872 0.95 PTGS2 (0.59) PTGS2CYP1A2CHRNB2CHRNA4CYP3A4
SCHEMBL597362 0.92 PTPN5 (0.49) PTGS2PTPN5RXRARXRBRXRG
Biphenyl SCHEMBL11314785 0.92 ALDH1A1 (0.53) PTGS2CYP1A2ALDH1A1CHRNB2CHRNA4
Isopropylbenzene SCHEMBL28501561 0.92 RXRA (0.48) PTGS2CYP1A2ALDH1A1CHRNB2CHRNA4
Sulfur Dioxide SCHEMBL28639552 0.91 PTGS2 (0.55) PTGS2CYP1A2CHRNB2CHRNA4CYP3A4
SCHEMBL10598462 0.91 RXRA (0.55) PTGS2CYP1A2CHRNB2CHRNA4CYP3A4
Bicarbonate SCHEMBL27623724 0.91 PTGS2 (0.67) PTGS2CYP1A2PTPN5RXRARXRB

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

Appears in 2724 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113600190-B Copper (II) -doped carbon nanotube material and preparation method and application thereof 浙江工业大学 2025-01-07 CN claimed
US-12146089-B2 Nanostructure ink compositions for inkjet printing SHOEI CHEMICAL INC. (JP) 2024-11-19 US claimed
US-12069877-B2 Composition for manufacturing light-emitting device, light-emitting device manufactured by the same, and method of manufacturing the light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2024-08-20 US claimed
EP-4007800-B1 NANOSTRUCTURE INK COMPOSITIONS FOR INKJET PRINTING SHOEI CHEMICAL IND CO (JP) 2024-01-03 EP claimed
CN-117255603-A Film processing method, photoelectric device, preparation method of photoelectric device and display device TCL科技集团股份有限公司 2023-12-19 CN claimed
CN-115433486-B Printing ink, light emitting device and display device 广东聚华印刷显示技术有限公司 2023-12-05 CN claimed
US-20230235225-A1 Nanostructure Ink Compositions for Inkjet Printing NANOSYS, INC. (US) 2023-07-27 US claimed
CN-113493628-B Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2023-06-23 CN claimed
CN-115433486-A Printing ink, light emitting device and display device 广东聚华印刷显示技术有限公司 2022-12-06 CN claimed
CN-113122050-B Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2022-11-04 CN claimed
US-4795493-A ISOPROPYLBIPHENYLS AS ODORLESS SOLVENT KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-01-03 US claimed
EP-0285280-A1 Process for selectively alkylating biphenyl KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-10-05 EP claimed
US-4774136-A ISOPROPYLBIPHENYLS AND ISOPROPYLNAPHTHALENES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-09-27 US claimed
US-4750083-A MIXTURES OF ETHYL BIPHENYLS AND ISOPROPYL BIPHENYLS; LOW TEMPERATURE PROPERTIES NIPPON PETROCHEMICALS COMPANY, LTD. (JP) 1988-06-07 US claimed
EP-0267759-A2 Oxidation process of aromatic compounds KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-05-18 EP claimed
EP-0262455-A2 Electrical insulating oil composition NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-04-06 EP claimed
EP-0244531-A1 Solvent for chromogenic dye-precursor material for pressure sensitive recording paper KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-11-11 EP claimed
EP-0243554-A1 Solvent for chromogenic dye-precursor material for pressure-sensitive recording paper KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-11-04 EP claimed
US-4699658-A ISOPROPYLBIPHENYL DERIVATIVES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-10-13 US claimed
US-4699659-A ISOPROPYLATED BIPHENYLS OR NAPHTHALENES; ODORLESS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-10-13 US claimed