SCHEMBL5489087

SCHEMBL5489087

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

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.39
HPGD P15428 1/20 0.39
THRB P10828 3/20 0.37
ALDH1A1 P00352 5/20 0.35
TP53 P04637 3/20 0.35
HIF1A Q16665 3/20 0.35
CYP3A4 P08684 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 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
SCHEMBL29029671 0.81 TSHR (0.41) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL29073795 0.81 TSHR (0.40) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL18166514 0.80 TSHR (0.37) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL29407615 0.79 ALDH1A1 (0.42) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL27444642 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL1070261 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL1898814 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL19495089 0.79 TSHR (0.36) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL302801 0.78 THRB (0.43) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL9578343 0.78 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53

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
US-7217769-B2 Medical device with plasma cross-linked hydrophilic coating BIOSURFACE ENGINEERING TECHNOLOGIES, INC. (US) 2007-05-15 US disclosed
US-20040258931-A1 Medical device with plasma cross-linked hydrophilic coating BIOSURFACE ENGINEERING TECHNOLOGIES, INC. 2004-12-23 US disclosed
US-6765069-B2 FORMED FROM N-TRIMETHYLSILYL-ALLYLAMINE, ETHYLENE, PROPYLENE AND ALLYL ALCOHOL; FOR USE ON MEDICAL EQUIPMENT, COSMETICS BIOSURFACE ENGINEERING TECHNOLOGIES, INC. 2004-07-20 US disclosed
US-20030091827-A1 Plasma cross-linked hydrophilic coating BIOSURFACE ENGINEERING TECHNOLOGIES, INC. 2003-05-15 US disclosed
WO-2003027152-A1 PLASMA CROSS-LINKED HYDROPHILIC COATING BIOSURFACE ENGINEERING TECHNOLOGIES, INC. (US) 2003-04-03 WO disclosed
US-5871823-A ACTIVATION OF POLYMER WITH ULTRAVIOLET LIGHT IN THE PRESENCE OF OXYGEN, IMMERSION AND GRAFT POLYMERIZATION WITH VINYL MONOMER HUELS AKTIENGESELLSCHAFT (DE) 1999-02-16 US disclosed