SCHEMBL7037635

SCHEMBL7037635

C=C(CC(C)=O)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
TSHR P16473 3/20 0.47
LMNA P02545 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 2/20 0.44
GLO1 Q04760 1/20 0.43
MGAM O43451 2/20 0.42
GAA P10253 2/20 0.42
SI P14410 2/20 0.42
MGAM2 Q2M2H8 2/20 0.42
THRB P10828 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
NPSR1 Q6W5P4 1/20 0.39
CYP2D6 P10635 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALOX15 P16050 1/20 0.37
SOAT1 P35610 1/20 0.37

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
SCHEMBL272491 0.90 ALDH1A1 (0.42) ALDH1A1TSHRLMNAHSD17B10MAPT
SCHEMBL8580106 0.86 ALDH1A1 (0.47) ALDH1A1TSHRLMNAHSD17B10MAPT
SCHEMBL6578505 0.82 MGAM (0.45) ALDH1A1TSHRLMNAHSD17B10MAPT
SCHEMBL253505 0.82 ALDH1A1 (0.37) ALDH1A1TSHRMAPTMGAMGAA
SCHEMBL60515 0.82 GAA (0.61) ALDH1A1TSHRLMNAHSD17B10MAPT
SCHEMBL10266670 0.82 ALDH1A1 (0.47) ALDH1A1TSHRLMNAHSD17B10MAPT
SCHEMBL262250 0.82 EGLN1 (0.50) ALDH1A1TSHRLMNAHSD17B10MAPT
SCHEMBL323091 0.81
SCHEMBL21996294 0.80 ALDH1A1 (0.45) ALDH1A1TSHRLMNAHSD17B10MAPT
Hydrochloric Acid SCHEMBL10882428 0.80 GAA (0.58) ALDH1A1TSHRLMNAHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115943059-A Three-dimensional printing 惠普发展公司,有限责任合伙企业 2023-04-07 CN disclosed
CN-109369839-B Self-crosslinking vinyl chloride copolymer emulsion and preparation method thereof 无锡洪汇新材料科技股份有限公司 2020-12-29 CN disclosed
CN-110869851-A Underlayer coating forming composition, pattern forming method, and copolymer for forming underlayer coating forming pattern 王子控股株式会社 2020-03-06 CN disclosed
US-20030032736-A1 Acrylic adhesive compositions containing ketonyl (meth)acrylate KNEAFSEY BRENDAN J (IE) 2003-02-13 US disclosed
WO-2001051576-A1 ACRYLIC ADHESIVE COMPOSITIONS CONTAINING KETONYL (METH)ACRYLATE LOCTITE (R & D) LIMITED (IE) 2001-07-19 WO disclosed