SCHEMBL7559441

SCHEMBL7559441

C=CCOC(=O)C(=COC(=O)CC(C)=O)CC

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL7117650 0.83 TSHR (0.37) TSHRMGAMGAASIMGAM2
SCHEMBL28205298 0.78 TSHR (0.45) TSHRMGAMGAASIMGAM2
SCHEMBL28537688 0.76 TSHR (0.39) TSHRTDP1MAPTCACNA1BAPBA1
SCHEMBL370148 0.75 MGAM (0.41) MGAMGAASIMGAM2TDP1
SCHEMBL5143366 0.74 GAA (0.38) TSHRMGAMGAASIMGAM2
SCHEMBL9513 0.74 TSHR (0.50) TSHRMGAMGAASIMGAM2
SCHEMBL2221470 0.73 TSHR (0.48) TSHRMGAMGAASIMGAM2
SCHEMBL1616122 0.73 TSHR (0.48) TSHRMGAMGAASIMGAM2
SCHEMBL5702374 0.73 TSHR (0.48) TSHRMGAMGAASIMGAM2
Acetone SCHEMBL28861611 0.73 TSHR (0.48) TSHRMGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0897399-B1 ACRYLIC POLYMER COMPOUNDS DU PONT (US) 2002-01-02 EP disclosed
CN-1222070-A Aqueous nail coating compsn. containing copolymerized colorants EASTMAN CHEM CO (US) 1999-07-07 CN disclosed
EP-0897399-A1 ACRYLIC POLYMER COMPOUNDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-02-24 EP disclosed
US-5798426-A FROM BUTYL METHACRYLATE, STYRENE, ISOBORNYL METHACRYLATE; FORM HARD ADHERENT COATINGS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-08-25 US disclosed
WO-1997043325-A9 ACRYLIC POLYMER COMPOUNDS 1998-03-12 WO disclosed
WO-1997043325-A1 ACRYLIC POLYMER COMPOUNDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-11-20 WO disclosed