SCHEMBL28397408

SCHEMBL28397408

CC(C)CCCCCc1ccccc1OC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50
ADRB2 P07550 6/20 0.43
ADRB1 P08588 6/20 0.43
PPARA Q07869 2/20 0.43
PPARG P37231 1/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LTB4R Q15722 2/20 0.41
LTB4R2 Q9NPC1 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL10599953 1.00 THRA (0.50) THRATHRBADRB2ADRB1PPARA
SCHEMBL19181639 0.90 THRA (0.51) THRATHRBADRB2ADRB1PPARA
SCHEMBL7648680 0.88 PPARG (0.52) THRATHRBADRB2ADRB1PPARA
SCHEMBL248138 0.87 LTB4R (0.44) THRATHRBPPARAPPARGKDM4E
SCHEMBL1157237 0.87 PPARA (0.41) THRATHRBADRB2ADRB1PPARA
SCHEMBL247213 0.86 THRA (0.46) THRATHRBADRB2ADRB1PPARA
Acetic Acid SCHEMBL9302793 0.85 THRA (0.44) THRATHRBADRB2ADRB1PPARA
SCHEMBL21681728 0.83 THRA (0.69) THRATHRBPPARAPPARGLTB4R
SCHEMBL1836583 0.83 THRA (0.69) THRATHRBPPARAPPARGLTB4R
SCHEMBL5682830 0.83 THRA (0.69) THRATHRBPPARAPPARGLTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153776-B Copolycarbonate as support material in 3D printing 科思创德国股份有限公司 2021-03-12 CN disclosed
CN-107207845-B Copolycarbonate compositions comprising PE-waxes with improved processability 科思创德国股份有限公司 2021-03-12 CN disclosed
CN-107207846-B Copolycarbonate compositions comprising diglyceride with improved rheological and optical properties 科思创德国股份有限公司 2020-05-19 CN disclosed