SCHEMBL7535767

SCHEMBL7535767

CCC=C(C)C(=O)OCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.41
TSHR P16473 5/20 0.38
ALDH1A1 P00352 5/20 0.37
THRB P10828 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.34
LMNA P02545 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
ESR1 P03372 1/20 0.33
CHRM1 P11229 1/20 0.33
SLC6A2 P23975 1/20 0.33
KDR P35968 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
POLB P06746 1/20 0.33
GLO1 Q04760 1/20 0.33
PPARG P37231 1/20 0.33
HPGD P15428 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL10621006 1.00 HCAR2 (0.41) HCAR2TSHRALDH1A1THRBGAA
SCHEMBL12984317 0.91 THRB (0.42) HCAR2TSHRALDH1A1THRBATM
SCHEMBL374983 0.88 ALDH1A1 (0.54) HCAR2TSHRALDH1A1SMN1; SMN2ATM
SCHEMBL7752796 0.88 ALDH1A1 (0.54) HCAR2TSHRALDH1A1SMN1; SMN2ATM
SCHEMBL375532 0.86 TSHR (0.56) HCAR2TSHRALDH1A1SMN1; SMN2ATM
SCHEMBL10620372 0.86 TSHR (0.56) HCAR2TSHRALDH1A1SMN1; SMN2ATM
SCHEMBL24228 0.85 TSHR (0.39) TSHRALDH1A1THRBGAALMNA
SCHEMBL11330538 0.85 CYP2D6 (0.40) HCAR2TSHRALDH1A1THRBGAA
SCHEMBL5293380 0.85 HCAR2 (0.39) HCAR2TSHRALDH1A1THRBGAA
SCHEMBL15475974 0.85 HCAR2 (0.39) HCAR2TSHRALDH1A1THRBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048117-A2 In-mold coating compositions containing a non-isocyanate-reactive unsaturated resin, a non-isocyanate-reactive monomer and a free isocyanate-containing compound ICI AMERICAS INC. (US) 1982-03-24 EP claimed
CN-110563933-B Preparation method of ultrahigh molecular weight PBS 宁波窦氏化学科技有限公司 2022-03-11 CN disclosed
CN-108699169-B Method for producing resin 昭和电工株式会社 2020-11-27 CN disclosed
CN-111684358-A Photosensitive resin composition 日产化学株式会社 2020-09-18 CN disclosed
CN-111512232-A Red curable resin composition, color filter, and display device 东友精细化工有限公司 2020-08-07 CN disclosed
CN-111033259-A Substrate for biochip, method for producing biochip, and method for storing biochip 三菱瓦斯化学株式会社 2020-04-17 CN disclosed
CN-110563933-A Preparation method of ultrahigh molecular weight PBS 宁波窦氏化学科技有限公司 2019-12-13 CN disclosed
EP-1030870-B1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED HYDROXYL CONTAINING ADDITIVE DU PONT (US) 2002-04-17 EP disclosed
EP-1030870-A1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED HYDROXYL CONTAINING ADDITIVE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-08-30 EP disclosed
US-5914384-A ACRYLIC POLYMERS; SOIL RESISTANCE, WEATHER RESISTANCE, TOUGHNESS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-22 US disclosed
WO-1999026994-A1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED HYDROXYL CONTAINING ADDITIVE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-03 WO disclosed
US-4748145-A Catalysts having alkoxide-modified supports and method of increasing the catalytic activity of a catalytic metal THE DOW CHEMICAL COMPANY (US) 1988-05-31 US disclosed
US-4743705-A FROM HALOALKENE, ALCOHOL OR ETHER, CARBON MONOXIDE THE DOW CHEMICAL COMPANY (US) 1988-05-10 US disclosed
US-4686314-A CALCINING METAL ALKOXIDE TO GLUE METAL OXIDE THE DOW CHEMICAL COMPANY (US) 1987-08-11 US disclosed
EP-0225953-A1 Catalysts having alkoxide-modified supports THE DOW CHEMICAL COMPANY (US) 1987-06-24 EP disclosed