SCHEMBL28006183

SCHEMBL28006183

CCCCCCc1ccccc1SOSc1ccccc1CCCCCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.51
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
ALOX5 P09917 2/20 0.42
PTGS2 P35354 1/20 0.42
CYSLTR2 Q9NS75 6/20 0.42
CYSLTR1 Q9Y271 6/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
TYR P14679 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PPARA Q07869 2/20 0.41

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
SCHEMBL27869265 1.00 LIPG (0.51) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL28006182 0.93 LIPG (0.42) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL10881276 0.85 HTR1A (0.39) LIPGPTGS2PPARAPPARG
SCHEMBL10698150 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL786161 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL1800362 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL5443171 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL7165241 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL9187842 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL11645709 0.83 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109843963-A Isocyanate composition, method for producing isocyanate polymer, and isocyanate polymer 旭化成株式会社 2019-06-04 CN disclosed
CN-109803992-A The manufacturing method of isocyanate composition and isocyanate polymer 旭化成株式会社 2019-05-24 CN disclosed
CN-109790269-A Isocyanate composition, method for producing isocyanate composition, and method for producing isocyanate polymer 旭化成株式会社 2019-05-21 CN disclosed
CN-106008269-B Polyisocyantates composition and isocyanate polymer composition 旭化成株式会社 2018-10-19 CN disclosed
CN-107963982-A Polyisocyantates composition and isocyanate polymer composition 旭化成株式会社 2018-04-27 CN disclosed
CN-104619682-B Polyisocyanate composition and isocyanate polymer composition 旭化成株式会社 2018-01-19 CN disclosed
CN-107056656-A Polyisocyantates composition and isocyanate polymer composition 旭化成株式会社 2017-08-18 CN disclosed
CN-106008269-A POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION 旭化成株式会社 2016-10-12 CN disclosed
CN-105924370-A Polyisocyanate Composition And Isocyanate Polymer Composition 旭化成株式会社 2016-09-07 CN disclosed
CN-104619682-A Polyisocyanate composition and isocyanate polymer composition ASAHI KASEI CHEMICALS CORP 2015-05-13 CN disclosed