SCHEMBL8955893

SCHEMBL8955893

C=C(C)C(=O)OCC(CCCC)C(C)OC(=O)C(=C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
THRB P10828 1/20 0.37
FAAH O00519 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CYP3A4 P08684 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PRKCA P17252 3/20 0.33
ALDH1A1 P00352 3/20 0.32
PRKCE Q02156 1/20 0.31
PRKCQ Q04759 1/20 0.31
PRKCD Q05655 1/20 0.31
MAPT P10636 1/20 0.31
PLA2G2C Q5R387 1/20 0.31
LMNA P02545 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
SCHEMBL28090040 0.86 TSHR (0.42) TSHRTHRBFAAHCA1CA2
SCHEMBL6670935 0.84 TSHR (0.53) TSHRTHRBFAAHCA1CA2
SCHEMBL6673452 0.84 TSHR (0.41) TSHRTHRBFAAHCA1CA2
SCHEMBL4384013 0.81 TSHR (0.53) TSHRTHRBFAAHCA1PRKCA
SCHEMBL8955894 0.81 TSHR (0.45) TSHRTHRBCA1CA2CYP3A4
SCHEMBL8956263 0.81 TSHR (0.45) TSHRTHRBFAAHCA1CA2
SCHEMBL730445 0.80 TSHR (0.50) TSHRTHRBCA1CA2CYP3A4
SCHEMBL1897951 0.79 TSHR (0.58) TSHRTHRBFAAHCA1CA2
SCHEMBL22231308 0.79 TSHR (0.42) TSHRTHRBFAAHCYP3A4TDP1
Hydrochloric Acid SCHEMBL4932417 0.78 TSHR (0.47) TSHRTHRBFAAHCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0690080-A2 Hindered-hydroxyl functional (meth) acrylate monomers containing di (meth) acrylates and compositions including same UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1996-01-03 EP claimed
US-5442023-A Without premature crosslinking or gel formation; curable protective coatings, inks, adhesives UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1995-08-15 US claimed
EP-0690080-A2 Hindered-hydroxyl functional (meth) acrylate monomers containing di (meth) acrylates and compositions including same UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1996-01-03 EP disclosed
US-5442023-A Without premature crosslinking or gel formation; curable protective coatings, inks, adhesives UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1995-08-15 US disclosed