SCHEMBL6155532

SCHEMBL6155532

C=C(C)C(=O)OC1(C2CO2)CC1.C=C(CC)C(=O)OCCCCCC

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
NAAA Q02083 3/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 2/20 0.32
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
EPHX1 P07099 1/20 0.31
THRB P10828 1/20 0.31
GBA2 Q9HCG7 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PRKCA P17252 3/20 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
SCHEMBL316721 0.81 TSHR (0.51) TSHRALDH1A1NPSR1THRBPRKCA
SCHEMBL7539773 0.79 ALDH1A1 (0.35) TSHRALDH1A1
SCHEMBL10594310 0.78 TSHR (0.83) TSHRNAAAALDH1A1HTTPOLB
SCHEMBL6563295 0.78 TSHR (0.83) TSHRNAAAALDH1A1HTTPOLB
SCHEMBL109019 0.78 ALDH1A1 (0.44) ALDH1A1
SCHEMBL4437013 0.77 TSHR (0.80) TSHRNAAAALDH1A1HTTPOLB
SCHEMBL15910521 0.77 TSHR (0.47) TSHRALDH1A1NPSR1
SCHEMBL11850141 0.75 TSHR (0.70) TSHRNAAAALDH1A1RAD52NPSR1
SCHEMBL3503795 0.75 TSHR (0.69) TSHRNAAAALDH1A1RAD52NPSR1
SCHEMBL11803516 0.75 TSHR (0.69) TSHRNAAAALDH1A1RAD52NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050037168-A1 Thermoformed food trays having improved toughness ASSOCIATED PACKAGING ENTERPRISES, INC. (US) 2005-02-17 US claimed
US-20020082346-A1 Thermoplastic compositions having high dimensional stability APEX RESEARCH LTD., INC. 2002-06-27 US claimed
EP-1238011-B1 THERMOPLASTIC COMPOSITIONS HAVING HIGH DIMENSIONAL STABILITY ASSOCIATED PACKAGING ENTPR INC (US) 2005-02-02 EP disclosed
US-6576309-B2 Thermoplastic compositions having high dimensional stability ASSOCIATED PACKAGING ENTERPRISES 2003-06-10 US disclosed
EP-1238011-A1 THERMOPLASTIC COMPOSITIONS HAVING HIGH DIMENSIONAL STABILITY Apex Research Ltd., Inc. (US) 2002-09-11 EP disclosed
US-20020111427-A1 Thermoplastic containers having high dimensional stability APEX RESEARCH LTD., INC. 2002-08-15 US disclosed
US-20020082346-A1 Thermoplastic compositions having high dimensional stability APEX RESEARCH LTD., INC. 2002-06-27 US disclosed
US-20020055586-A1 THERMOPLASTIC COMPOSITIONS HAVING HIGH DIMENSIONAL STABILITY ASSOCIATED PACKAGING ENTERPRISES, INC. 2002-05-09 US disclosed
WO-2001040377-A1 THERMOPLASTIC COMPOSITIONS HAVING HIGH DIMENSIONAL STABILITY APEX RESEARCH LTD., INC. (US) 2001-06-07 WO disclosed