SCHEMBL7559435

SCHEMBL7559435

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

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
GAA P10253 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
MAPT P10636 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
ALDH1A1 P00352 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP3A4 P08684 1/20 0.30
LMNA P02545 1/20 0.30
PKM P14618 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9294641 0.84 TDP1 (0.37) TSHRTDP1GAAMGAMSI
SCHEMBL28288556 0.82 GAA (0.42) TSHRGAAMGAMSIMGAM2
SCHEMBL27993988 0.82 MGAM (0.45) TSHRGAAMGAMSIMGAM2
SCHEMBL13732027 0.81 LMNA (0.37) TSHRGAAMGAMSIMGAM2
SCHEMBL9513 0.79 TSHR (0.50) TSHRTDP1GAAMGAMSI
Acrylic Acid Methyl Ester SCHEMBL28099015 0.79 MGAM (0.36) TSHRGAAMGAMSIMGAM2
SCHEMBL5134550 0.77 TSHR (0.48) TSHRTDP1GAAMGAMSI
SCHEMBL5702374 0.77 TSHR (0.48) TSHRTDP1GAAMGAMSI
SCHEMBL2221470 0.77 TSHR (0.48) TSHRTDP1GAAMGAMSI
SCHEMBL1616122 0.77 TSHR (0.48) TSHRTDP1GAAMGAMSI

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