SCHEMBL3031121

SCHEMBL3031121

CCCCCCCCCc1ccccc1OP(O)OCC(C)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
ADRB2 P07550 7/20 0.44
ADRB1 P08588 6/20 0.44
LIPG Q9Y5X9 1/20 0.42
ALOX5 P09917 1/20 0.42
PTGS2 P35354 1/20 0.42
PPARA Q07869 2/20 0.40
PPARG P37231 1/20 0.39
LTB4R Q15722 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.37
CYSLTR2 Q9NS75 2/20 0.36
CYSLTR1 Q9Y271 2/20 0.36

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
SCHEMBL29778064 0.85 THRA (0.58) THRATHRBADRB2ADRB1LIPG
SCHEMBL28376630 0.85 THRA (0.58) THRATHRBADRB2ADRB1LIPG
SCHEMBL317708 0.85 THRA (0.58) THRATHRBADRB2ADRB1LIPG
SCHEMBL8433693 0.85 THRA (0.58) THRATHRBADRB2ADRB1LIPG
SCHEMBL8372832 0.85 THRA (0.58) THRATHRBADRB2ADRB1LIPG
SCHEMBL9382266 0.84 THRA (0.45) THRATHRBADRB2ADRB1LIPG
SCHEMBL11042199 0.84 THRA (0.45) THRATHRBADRB2ADRB1LIPG
SCHEMBL28191406 0.84 THRA (0.52) THRATHRBLIPGALOX5PTGS2
SCHEMBL10348761 0.83 THRA (0.56) THRATHRBLIPGALOX5PTGS2
Propylene Glycol SCHEMBL3031124 0.82 THRA (0.50) THRATHRBADRB2ADRB1LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7749579-B2 Rolled optical film KONICA MINOLTA OPTO, INC. (JP) 2010-07-06 US disclosed
US-20070128381-A1 ROLLED OPTICAL FILM KONICA MINOLTA OPTO, INC. (JP) 2007-06-07 US disclosed