SCHEMBL14214966

SCHEMBL14214966

C=C(C)C(=O)OCCCOC(=O)CC

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.63
THRB P10828 1/20 0.55
NAAA Q02083 1/20 0.53
HTT P42858 2/20 0.47
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 3/20 0.39
RAD52 P43351 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
DGKA P23743 1/20 0.35
GAA P10253 2/20 0.35
HPGD P15428 1/20 0.34
FAAH O00519 1/20 0.33
DNM1 Q05193 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL18214977 0.96 TSHR (0.69) TSHRTHRBNAAAHTTPOLB
SCHEMBL6418779 0.94 TSHR (0.72) TSHRTHRBNAAAHTTPOLB
SCHEMBL1652027 0.92 THRB (0.64) TSHRTHRBNAAAHTTPOLB
SCHEMBL7760391 0.88 TSHR (0.62) TSHRTHRBNAAAHTTPOLB
SCHEMBL182045 0.87 TSHR (0.72) TSHRTHRBNAAAHTTPOLB
SCHEMBL18214984 0.86 THRB (0.69) TSHRTHRBNAAAHTTPOLB
SCHEMBL13862878 0.86 TSHR (0.49) TSHRTHRBNAAAHTTPOLB
SCHEMBL1197880 0.86 TSHR (0.60) TSHRTHRBNAAAHTTPOLB
SCHEMBL9162964 0.85 TSHR (0.69) TSHRTHRBNAAAHTTPOLB
SCHEMBL11600594 0.85 TSHR (0.69) TSHRTHRBNAAAHTTPOLB

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
CN-1079799-C Encapsulated hydrophilic polymers and their preparation ROHM & HAAS (US) 2002-02-27 CN claimed
CN-1130634-A Encapsulated hydrophilic polymers and their preparation ROHM & HAAS (US) 1996-09-11 CN claimed
CN-1040039-A Absorbed the light tight polymer beads of multilayer of non-polymeric acid ROHM & HAAS (US) 1990-02-28 CN claimed
CN-101903416-B Aqueous polymer dispersions and method for the production and use thereof BASF SE 2015-01-14 CN disclosed
CN-101863787-B Organic/inorganic hybrid photocuring moisture-proof material and preparation thereof UNIV BEIJING CHEMICAL 2013-10-30 CN disclosed
CN-101903416-A Aqueous polymer dispersions, method for the production and use thereof BASF SE 2010-12-01 CN disclosed
CN-101863787-A Organic/inorganic hybrid photocuring moisture-proof material and preparation thereof UNIV BEIJING CHEMICAL 2010-10-20 CN disclosed
US-7379131-B2 Liquid crystal display device FUJIFILM CORPORATION (JP) 2008-05-27 US disclosed
US-7315341-B2 Liquid crystal display device with retardation layer with different relative humidity FUJIFILM CORPORATION (JP) 2008-01-01 US disclosed
CN-1182763-A Low glass coating composition ROHM & HAAS (US) 1998-05-27 CN disclosed
CN-1084410-A Relate to the improvement of contrast agent NYCOMED IMAGING AS (NO) 1994-03-30 CN disclosed
CN-1017339-B Method for producing fine capsule dispersion ROHM & HAAS (US) 1992-07-08 CN disclosed