SCHEMBL2869063

SCHEMBL2869063

Cc1[c]ccc(C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
BCHE P06276 6/20 0.33
ACHE P22303 6/20 0.33
HDAC4 P56524 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
NPC1 O15118 1/20 0.32
PLA2G1B P04054 1/20 0.32

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
SCHEMBL4580414 0.86 ESR1 (0.41) TSHRALDH1A1HPGDALOX15HSD17B10
SCHEMBL3945118 0.82 ESR1 (0.30)
SCHEMBL2865616 0.82 ESR1 (0.43) TSHRALDH1A1HPGDALOX15HSD17B10
SCHEMBL8782236 0.80
SCHEMBL95846 0.79 KIF11 (0.36) TSHRALDH1A1MAPTKIF11
SCHEMBL15067852 0.78 ALDH1A1 (0.39) TSHRALDH1A1HPGDALOX15HSD17B10
SCHEMBL11817162 0.77 SHBG (0.42) TSHRALDH1A1TDP1MEN1GAA
SCHEMBL226186 0.76 ALDH1A1 (0.38) TSHRALDH1A1HPGDALOX15HSD17B10
SCHEMBL699200 0.76
SCHEMBL1867226 0.74 ALDH1A1 (0.37) TSHRALDH1A1HPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113683650-A Preparation method of beta-D- (1,4) -mannuronic acid oligosaccharide and intermediate thereof 绿谷(上海)医药科技有限公司 2021-11-23 CN claimed
CN-111051326-A Nucleoside phosphate compound and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2020-04-21 CN claimed
EP-2054494-B2 FLAVOR OILS WITH REDUCED SULFUR CONTENT AND USE IN ORAL CARE COMPOSITIONS PROCTER & GAMBLE (US) 2016-07-27 EP claimed
EP-0463488-B2 O-Benzyl oxime ethers and fungicides containing them BASF AG (DE) 2004-04-21 EP claimed
EP-1244753-B1 LIQUID GOLD COMPOSITIONS JOHNSON MATTHEY PLC (GB) 2004-02-11 EP claimed
EP-1244753-A1 LIQUID GOLD COMPOSITIONS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-10-02 EP claimed
WO-2001040392-A1 LIQUID GOLD COMPOSITIONS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2001-06-07 WO claimed
US-6008306-A COMPOSITION OF STRAINED CYCLOOLEFIN AND A DIVALENT CATIONIC RUTHENIUM OR OSMIUM BOUND TO 1-3 TERTIARY PHOSPHINE LIGANDS, THE PHOSPHINE GROUPS CONTAIN PHENYL SUBSTITUTED BY ALKYL, ALKOXY OR HALOALKYL GROUPS; IMPROVED CATALYTIC ACTIVITY CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-12-28 US claimed
EP-0669315-A1 Ortho substituted phenylacetic acid amides BASF AKTIENGESELLSCHAFT (DE) 1995-08-30 EP claimed
CN-116535736-A Anti-aging agent composition, application thereof and polyurethane chest cotton comprising anti-aging agent composition 天津利安隆新材料股份有限公司 2023-08-04 CN disclosed
CN-111251493-B Granulation method of hindered amine light stabilizer 天津利安隆新材料股份有限公司 2022-05-31 CN disclosed
CN-110473989-B Method for manufacturing organic light emitting element 株式会社LG化学 2022-05-27 CN disclosed
CN-111251494-B Preparation method of low-melting-point weather-resistant auxiliary agent master batch 天津利安隆新材料股份有限公司 2022-03-29 CN disclosed
CN-113683650-A Preparation method of beta-D- (1,4) -mannuronic acid oligosaccharide and intermediate thereof 绿谷(上海)医药科技有限公司 2021-11-23 CN disclosed
EP-0008177-A1 Vulcanizable rubber compositions containing substituted carbamic acid esters MONSANTO COMPANY (US) 1980-02-20 EP disclosed
US-4156680-A Scorch inhibited vulcanizable rubber compositions containing carbamic acid esters MONSANTO COMPANY (US) 1979-05-29 US disclosed
EP-0001249-A1 Process for preparing substituted 1-aminoanthraquinones BAYER AG (DE) 1979-04-04 EP disclosed
US-4137273-A INSECTICIDES, CHEMICAL INTERMEDIATES ZOECON CORPORATION (US) 1979-01-30 US disclosed
US-4107138-A Phosphonous and thiophosphonous acid ethers as stabilizers for organic materials SANDOZ LTD. (CH) 1978-08-15 US disclosed
US-4042567-A S-Triazine prepolymers and a process for their production BAYER AKTIENGESELLSCHAFT (DT) 1977-08-16 US disclosed