SCHEMBL6232516

SCHEMBL6232516

C=C(OCCC)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
TSHR P16473 3/20 0.47
THRB P10828 1/20 0.41
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GLO1 Q04760 1/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
TRPA1 O75762 1/20 0.34

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
SCHEMBL6283556 0.91 THRB (0.45) ALDH1A1TSHRTHRBMAPTNPSR1
SCHEMBL6234359 0.91 TSHR (0.47) ALDH1A1TSHRTHRBMAPTLMNA
SCHEMBL28405641 0.88 THRB (0.48) ALDH1A1TSHRTHRBMAPTNPSR1
SCHEMBL1109724 0.87 TSHR (0.50) ALDH1A1TSHRTHRBLMNAHCAR2
SCHEMBL94679 0.85 ALDH1A1 (0.54) ALDH1A1TSHRTHRBMAPTNPSR1
SCHEMBL11562740 0.85 TSHR (0.58) ALDH1A1TSHRNPSR1LMNAHCAR2
SCHEMBL4139152 0.84 ALDH1A1 (0.45) ALDH1A1TSHRTHRBMAPTNPSR1
SCHEMBL27685120 0.84 THRB (0.63) ALDH1A1TSHRTHRBMAPTLMNA
Hydrochloric Acid SCHEMBL27667582 0.83 ALDH1A1 (0.52) ALDH1A1TSHRTHRBMAPTNPSR1
SCHEMBL6238875 0.83 TSHR (0.55) ALDH1A1TSHRTHRBNPSR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110959019-A Block copolymer and method for producing block copolymer 电化株式会社 2020-04-03 CN claimed
EP-3805313-B1 ACRYLIC ELASTOMER COMPOSITION DENKA COMPANY LTD (JP) 2023-05-03 EP disclosed
CN-110959019-B Block copolymer and method for producing block copolymer 电化株式会社 2022-10-14 CN disclosed
CN-114901448-A Polymer blends 杜邦聚合物公司 2022-08-12 CN disclosed
CN-109312138-B Acrylic rubber composition 电化株式会社 2021-07-09 CN disclosed
CN-109312137-B Acrylic rubber composition 电化株式会社 2021-07-09 CN disclosed
CN-113072758-A Nucleating agent for polyolefin resin, nucleating agent composition for polyolefin resin, master batch, and polyolefin resin composition 株式会社ADEKA 2021-07-06 CN disclosed
CN-111630099-B Nucleating agent for polyolefin resin, nucleating agent composition for polyolefin resin containing same, and polyolefin resin composition 株式会社ADEKA 2021-04-20 CN disclosed
EP-3805313-A1 ACRYLIC ELASTOMER COMPOSITION Denka Company Limited (JP) 2021-04-14 EP disclosed
CN-112236474-A Acrylic elastomer composition 电化株式会社 2021-01-15 CN disclosed
EP-1348538-B1 Heat resistant fuel hose TOKAI RUBBER IND LTD (JP) 2005-06-01 EP disclosed
EP-0962311-B1 RUBBER LAMINATE AND USES THEREOF DAIKIN IND LTD (JP) 2004-12-08 EP disclosed
EP-1359183-A1 Method of vulcanized bonding of heat-resistant rubber Tokai Rubber Industries, Ltd. (JP) 2003-11-05 EP disclosed
US-20030188793-A1 Heat resistant fuel hose TOKAI RUBBER INDUSTRIES, LTD. (JP) 2003-10-09 US disclosed
US-20030187146-A1 Method of vulcanized bonding of heat-resistant rubber TOKAI RUBBER INDUSTRIES, LTD. (JP) 2003-10-02 US disclosed
EP-1348538-A1 Heat resistant fuel hose Tokai Rubber Industries, Ltd. (JP) 2003-10-01 EP disclosed
US-20030049399-A1 RUBBER LAMINATE AND USES THEREOF DAIKIN INDUSTRIES, LTD. (JP) 2003-03-13 US disclosed
EP-0962311-A1 RUBBER LAMINATE AND USES THEREOF DAIKIN INDUSTRIES, LIMITED (JP) 1999-12-08 EP disclosed
US-5688886-A ACRYLIC ESTER POLYMER PREPARED BY EMULSION POLYMERIZATION WITH A REDOX CATALYST IN A LOW OXYGEN ENVIRONMENT, IMPROVED COMPRESSION SET RESISTANCE, TENSILE STRENGTH, ROLL PROCESSABILITY, ULTRA-HIGH MOLECULAR WEIGHT SHOWA HIGHPOLYMER CO., LTD. (JP) 1997-11-18 US disclosed
US-4194051-A Asymmetric catalysis MONSANTO COMPANY (US) 1980-03-18 US disclosed