SCHEMBL6547407

SCHEMBL6547407

Cc1cccc(CCc2cccc(C)c2C)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
TAAR1 Q96RJ0 1/20 0.46
TRPA1 O75762 1/20 0.46
ATM Q13315 1/20 0.46
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
TSHR P16473 2/20 0.40
ACHE P22303 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL30231281 1.00 ESR1 (0.47) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL8072431 0.95 ESR1 (0.44) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL599914 0.90 ESR1 (0.44) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL29407427 0.90 ESR1 (0.44) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL29765276 0.87 ESR1 (0.43) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL1803036 0.87 POLB (0.46) TAAR1ALDH1A1
SCHEMBL6547392 0.87 TAAR1 (0.42) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL29712516 0.85 ESR1 (0.42) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL726804 0.85 TAAR1 (0.68) ESR1ESR2TAAR1TRPA1ATM
SCHEMBL10933913 0.85 ESR1 (0.42) ESR1ESR2TAAR1TRPA1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4128243-A None JP disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-6096680-A REUSABLE ALUMINUM FRIEDEL-CRAFTS CATALYSTS; FORMED FROM AN ALUMINUM TRIHALIDE, ALKALI METAL HALIDE OR PSEUDOHALIDE, ALKALINE EARTH METAL HALIDE, QUATERNARY AMMONIUM, PHOSPHONIUM AND/OR SULFONIUM SALT AND AN AROMATIC HYDROCARBON ALBEMARLE CORPORATION (US) 2000-08-01 US disclosed
WO-1999054038-A1 LIQUID CLATHRATE COMPOSITIONS ALBEMARLE CORPORATION (US) 1999-10-28 WO disclosed
US-5859302-A Processes employing reusable aluminum catalysts ALBEMARLE CORPORATION (US) 1999-01-12 US disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
EP-0838447-A1 Processes employing reusable aluminum catalysts ALBEMARLE CORPORATION (US) 1998-04-29 EP disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed
EP-0281162-B1 Method for improving the electrical insulating characteristics of a fraction, electrical insulating substance, and electrical appliances containing the same NIPPON PETROCHEMICALS CO LTD (JP) 1996-06-12 EP disclosed
EP-0464502-A1 Heat-sensitive recording material ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1992-01-08 EP disclosed
EP-0290050-B1 METHOD FOR PRODUCING ALKYLSTYRENE NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-08-21 EP disclosed
US-5026939-A Cracking 1,2-di(4-isobutylphenyl)ethane in contact with acid catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-06-25 US disclosed
EP-0115065-B1 PROCESS FOR PREPARING OIL-CONTAINING ELECTRICAL APPLIANCES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-09-06 EP disclosed
EP-0152083-B1 PROCESS FOR PRODUCING POWDER OF MICROCAPSULES KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1989-05-03 EP disclosed
EP-0290050-A1 Method for producing alkylstyrene NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-11-09 EP disclosed
EP-0281162-A2 Method for improving the electrical insulating characteristics of a fraction, electrical insulating substance, and electrical appliances containing the same NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-07 EP disclosed
US-4681980-A AROMATIC OLEFIN OIL NIPPON PETROCHEMICALS COMPANY LIMITED (JP) 1987-07-21 US disclosed
US-4601863-A Process for producing powder of microcapsules KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1986-07-22 US disclosed
EP-0115065-A2 Process for preparing oil-containing electrical appliances NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1984-08-08 EP disclosed