SCHEMBL8957437

SCHEMBL8957437

C=CC(=O)OCC(C)(C)C(=O)OC(=O)C(C)(C)COC(=O)C=C

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 2/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TSHR P16473 8/20 0.44
THRB P10828 3/20 0.43
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PRSS1 P07477 1/20 0.34
CTSG P08311 1/20 0.34
CTRB1 P17538 1/20 0.34
CMA1 P23946 1/20 0.34
THRA P10827 1/20 0.31

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
SCHEMBL828170 0.85 ALDH1A1 (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL5406653 0.85 ALDH1A1 (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL13324134 0.83 ALDH1A1 (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL9788877 0.82 ALDH1A1 (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL11760168 0.82 TSHR (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL11765108 0.82 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL15249363 0.82 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL9507667 0.80 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
Ethylene Glycol SCHEMBL28305502 0.80 ALDH1A1 (0.49) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL600748 0.80 TSHR (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4082634-A IONIZING OR ACTINIC RADIATION PPG INDUSTRIES, INC. (US) 1978-04-04 US claimed
US-4070497-A Process of applying and curing a plurality of coatings PPG INDUSTRIES, INC. (US) 1978-01-24 US claimed
EP-0690888-A1 FLOOR COVERINGS THE AMTICO COMPANY LIMITED (GB) 1996-01-10 EP disclosed
WO-1994021721-A1 FLOOR COVERINGS THE AMTICO COMPANY LIMITED (GB) 1994-09-29 WO disclosed
US-5284736-A Thermoplastic polymers with one bromo-substituted monomer plus acrylic carboxyls, amides MITSUBISHI RAYON CO., LTD. (JP) 1994-02-08 US disclosed
EP-0488339-A1 Flame-resistant photo-curable resin composition MITSUBISHI RAYON CO., LTD (JP) 1992-06-03 EP disclosed
EP-0469973-A1 Method for forming relief patterns MITSUBISHI RAYON CO., LTD (JP) 1992-02-05 EP disclosed
US-4113893-A RADIATION CURE OF COATING COMPOSITIONS CONTAINING DIACRYLATE MONOMER AND HIDING PIGMENT PPG INDUSTRIES, INC. (US) 1978-09-12 US disclosed
US-4082634-A IONIZING OR ACTINIC RADIATION PPG INDUSTRIES, INC. (US) 1978-04-04 US disclosed
US-4070497-A Process of applying and curing a plurality of coatings PPG INDUSTRIES, INC. (US) 1978-01-24 US disclosed
US-4064286-A RESISTANCE TO COLOR BLEACHING, CHALKING, IMPROVED GLOSS RETENTION PPG INDUSTRIES, INC. (US) 1977-12-20 US disclosed
US-4025407-A THERMOSETTING RESIN AND RADIATION SENSITIVE MATERIAL SUBJECTED TO IONIZING RADIATION OR ACTINIC LIGHT PPG INDUSTRIES, INC. (US) 1977-05-24 US disclosed
US-4016306-A CURING, ACRYLIC POLYMER AND A DIACRYLATE MITSUBISHI RAYON CO., LTD. (JA) 1977-04-05 US disclosed