SCHEMBL6546771

SCHEMBL6546771

CC(C)c1ccc(C(C)(C)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.56
ESR2 Q92731 4/20 0.56
CYP3A4 P08684 2/20 0.56
ALDH1A1 P00352 2/20 0.56
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
HIF1A Q16665 1/20 0.48
KIF11 P52732 2/20 0.45
NR3C2 P08235 3/20 0.44
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
PTPN5 P54829 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
AR P10275 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR6 P50406 1/20 0.41
ESRRG P62508 1/20 0.41

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
SCHEMBL16191360 0.91 CYP2C9 (0.50) ESR1ESR2CYP3A4ALDH1A1CYP2D6
SCHEMBL14136110 0.89 NR3C2 (0.49) ESR1ESR2CYP3A4ALDH1A1CYP2D6
Isopropylbenzene SCHEMBL10440206 0.86 ESR2 (0.74) ESR1ESR2CYP3A4ALDH1A1CYP2D6
SCHEMBL8750404 0.83 ESR1 (0.52) ESR1ESR2CYP3A4ALDH1A1NR3C2
SCHEMBL8750389 0.83 ESR1 (0.57) ESR1ESR2CYP3A4ALDH1A1NR3C2
SCHEMBL22223039 0.83 ESR1 (0.52) ESR1ESR2CYP3A4ALDH1A1HIF1A
SCHEMBL7535051 0.83 ESR1 (0.75) ESR1ESR2CYP3A4ALDH1A1NR3C2
SCHEMBL19424151 0.82 MEN1 (0.48) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL16191594 0.81 KIF11 (0.53) ESR1ESR2CYP3A4ALDH1A1KIF11
SCHEMBL11442679 0.81 MAPK1 (0.68) ESR1ESR2CYP3A4ALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4261037-A1 EPOXY RESIN COMPOSITION, CURED PRODUCT THEREOF, AND LAMINATE DIC Corporation (JP) 2023-10-18 EP disclosed
WO-2023095615-A1 EPOXY RESIN COMPOSITION, CURED PRODUCT THEREOF, AND LAMINATE DIC株式会社 2023-06-01 WO disclosed
WO-2021054771-A1 PHOSPHOROUS-CONTAINING RESIN ENDCAPPED WITH UNSATURATED GROUP, PREPARATION METHOD THEREFOR, AND RESIN COMPOSITION COMPRISING PHOSPHOROUS-CONTAINING RESIN ENDCAPPED WITH UNSATURATED GROUP 코오롱인더스트리 주식회사 2021-03-25 WO disclosed
US-20200225581-A1 PHOTOSENSITIVE RESIN COMPOSITION, OPTICAL FILM, AND METHOD OF PRODUCING OPTICAL FILM ECHEM SOLUTIONS CORP. (TW) 2020-07-16 US disclosed
EP-2595613-B1 COMPOUNDS FOR USE IN A METHOD OF PREVENTING OR TREATING VIRAL INFECTION US HEALTH (US) 2019-01-09 EP disclosed
EP-3150743-A2 BISMUTH ELECTROPLATING BATHS AND METHODS OF ELECTROPLATING BISMUTH ON A SUBSTRATE Rohm and Haas Electronic Materials LLC (US) 2017-04-05 EP disclosed
US-20150004484-A1 ORGANIC ELECTROLYTE AND ORGANIC ELECTROLYTE STORAGE BATTERY JX NIPPON OIL & ENERGY CORPORATION (JP) 2015-01-01 US disclosed
US-20140370375-A1 ORGANIC ELECTROLYTE AND ORGANIC ELECTROLYTE STORAGE BATTERY JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-12-18 US disclosed
EP-2797153-A1 ORGANIC ELECTROLYTE, AND ORGANIC ELECTROLYTE STORAGE BATTERY JX Nippon Oil & Energy Corporation (JP) 2014-10-29 EP disclosed
EP-2797154-A1 ORGANIC ELECTROLYTE, AND ORGANIC ELECTROLYTE STORAGE BATTERY JX Nippon Oil & Energy Corporation (JP) 2014-10-29 EP disclosed
CN-104025364-A Organic electrolyte, and organic electrolyte storage battery JX NIPPON OIL & ENERGY CORP 2014-09-03 CN disclosed
CN-104011928-A Organic electrolyte, and organic electrolyte storage battery JX NIPPON OIL & ENERGY CORP 2014-08-27 CN 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-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US 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