SCHEMBL8414717

SCHEMBL8414717

C=C(C)C(=O)OC.C=CC(=O)NCO.C=CC(=O)OCCCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.56
HPGD P15428 1/20 0.56
ALDH1A1 P00352 5/20 0.41
CYP3A4 P08684 1/20 0.41
ATM Q13315 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HCAR2 Q8TDS4 3/20 0.37
TP53 P04637 2/20 0.35
HIF1A Q16665 2/20 0.35
HSD17B10 Q99714 1/20 0.35
THRB P10828 2/20 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
Acrylic Acid SCHEMBL17765370 0.90 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL27965774 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL7532090 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL8170458 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL10893415 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL521825 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL35081 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL5844442 0.89 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
Ethylene Glycol SCHEMBL16819031 0.88 TSHR (0.65) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL28577918 0.88 TSHR (0.57) TSHRHPGDALDH1A1ATMZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5866297-A Providing imagewise variation in glossiness to a receptor IMATION CORP. (US) 1999-02-02 US disclosed
US-5756257-A Color proofing article incorporating novel antihalation dye IMATION CORP. (US) 1998-05-26 US disclosed
EP-0529789-B1 Negative single sheet color proofing system based on aqueous developable photo-oligomers MINNESOTA MINING & MFG (US) 1997-08-27 EP disclosed
EP-0790529-A2 Color proofing article incorporating novel antihalation dye Imation Corp. (US) 1997-08-20 EP disclosed
US-5635331-A REDUCED BLOCKING BETWEEN INDIVIDUAL SHEETS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-06-03 US disclosed
US-5633117-A Providing imagewise variation in glossiness to a receptor IMATION CORP. (US) 1997-05-27 US disclosed
EP-0740208-A1 Aqueous developable color proofing elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-30 EP disclosed
EP-0740209-A2 Method for providing imagewise variation in glossiness to a receptor MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-30 EP disclosed
EP-0712046-A1 Substrate having release agent/adhesive mixture coated thereon MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-05-15 EP disclosed
US-5310627-A Enhancing contrast, proofing elements for printing multicolor images MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-05-10 US disclosed
US-5248583-A Multilayer light sensitive element with carriers, release layers as oxygen barriers, photopolymerizable layers and thermal adhesives MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-09-28 US disclosed
EP-0529789-A1 Negative single sheet color proofing system based on aqueous developable photo-oligomers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-03-03 EP disclosed