SCHEMBL6911096

SCHEMBL6911096

CCCCC=C(C)OC(C)=CCCCC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 3/20 0.38
EP300 Q09472 1/20 0.37
GRIK1 P39086 1/20 0.33
LPAR2 Q9HBW0 2/20 0.31
LPAR3 Q9UBY5 2/20 0.31
LPAR1 Q92633 1/20 0.31
F7 P08709 1/20 0.31
F3 P13726 1/20 0.31
LMNA P02545 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL6911093 1.00 TSHR (0.38) TSHRALDH1A1EP300GRIK1LPAR2
SCHEMBL11801529 0.90 EP300 (0.48) TSHREP300F7F3LMNA
SCHEMBL11693855 0.90 EP300 (0.48) TSHREP300F7F3LMNA
SCHEMBL6060318 0.88 ALDH1A1 (0.43) TSHRALDH1A1EP300GRIK1F7
SCHEMBL4952452 0.84 EP300 (0.48) ALDH1A1EP300F7F3LMNA
SCHEMBL4952458 0.84 EP300 (0.48) ALDH1A1EP300F7F3LMNA
SCHEMBL19411365 0.83 EP300 (0.52) TSHREP300F7F3LMNA
SCHEMBL19411366 0.83 EP300 (0.52) TSHREP300F7F3LMNA
SCHEMBL7134783 0.78 FAAH (0.38) ALDH1A1EP300GRIK1
SCHEMBL7134787 0.78 FAAH (0.38) ALDH1A1EP300GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118338782-A Biocidal compositions 巴斯夫欧洲公司 2024-07-12 CN disclosed
EP-0953560-B1 Method, catalyst and apparatus for producing acetaldehyde from acetic acid EASTMAN CHEM CO (US) 2004-05-26 EP disclosed
US-6121498-A HYDROGENATING ACETIC ACID USING IRON OXIDE CATALYST THAT CONTAINS PALLADIUM, ABSORBING ACETALDEHYDE FROM GASEOUS PRODUCT USING SOLVENT CONTAINING ACETIC ACID EASTMAN CHEMICAL COMPANY (US) 2000-09-19 US disclosed
US-6114475-A PROVIDING COMPOUND IN SOLID, LIQUID, OR GASEOUS FORM CAPABLE OF REDUCING THE BOILING POINT OF WATER BY AT LEAST ABOUT 2 DEGREES C, VAPORIZING COMPOUND, PASSING COMPOUND IN GASEOUS FORM INTO COOL REGIONS OF THE SYSTEM TO MIX WITH WATER UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-09-05 US disclosed
EP-0953560-A1 Method, catalyst and apparatus for producing acetaldehyde from acetic acid EASTMAN CHEMICAL COMPANY (US) 1999-11-03 EP disclosed
EP-0451296-B1 FLUOROCOPOLYMER AND PRODUCTION THEREOF ASAHI GLASS CO LTD (JP) 1995-10-25 EP disclosed
US-5304617-A Containing fluoroolefin unit, vinyl ester or vinyl ether unit, hydroxyl group-containing vinyl ether unit; coating films ASAHI GLASS COMPANY LTD. (JP) 1994-04-19 US disclosed
EP-0262414-B1 Photocurable blends of 2-Methoxytetrahydropyran and cycloaliphatic epoxides UNION CARBIDE CORP (US) 1994-03-16 EP disclosed
EP-0451296-A1 FLUOROCOPOLYMER AND PRODUCTION THEREOF ASAHI GLASS COMPANY LTD. (JP) 1991-10-16 EP disclosed
US-4977199-A HIGH SPEED CURING UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) 1990-12-11 US disclosed
EP-0262414-A2 Photocurable blends of 2-Methoxytetrahydropyran and cycloaliphatic epoxides UNION CARBIDE CORPORATION (US) 1988-04-06 EP disclosed