SCHEMBL4444324

SCHEMBL4444324

CCCCCCCCCc1ccccc1OPOc1ccccc1CCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.54
THRB P10828 1/20 0.54
LIPG Q9Y5X9 1/20 0.51
PTGS2 P35354 3/20 0.50
ALOX5 P09917 1/20 0.50
PPARA Q07869 2/20 0.48
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
PPARG P37231 1/20 0.46
KCNH2 Q12809 1/20 0.43
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
TLR8 Q9NR97 1/20 0.41
KAT8 Q9H7Z6 1/20 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
SCHEMBL10832310 0.93 THRA (0.45) THRATHRBLIPGPTGS2ALOX5
SCHEMBL6855098 0.91 THRA (0.47) THRATHRBLIPGPTGS2ALOX5
SCHEMBL11370128 0.86 THRA (0.55) THRATHRBLIPGPTGS2ALOX5
SCHEMBL4443929 0.85 PTGS2 (0.50) THRATHRBLIPGPTGS2ALOX5
SCHEMBL6745885 0.85 PTGS2 (0.50) THRATHRBLIPGPTGS2ALOX5
SCHEMBL4454133 0.85 PTGS2 (0.50) THRATHRBLIPGPTGS2ALOX5
SCHEMBL4446465 0.85 PTGS2 (0.50) THRATHRBLIPGPTGS2ALOX5
SCHEMBL6743239 0.85 PTGS2 (0.50) THRATHRBLIPGPTGS2ALOX5
SCHEMBL1965860 0.85 PTGS2 (0.50) THRATHRBLIPGPTGS2ALOX5
SCHEMBL941553 0.83 THRA (0.58) THRATHRBLIPGPTGS2ALOX5

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-20090027586-A1 Thermoplastic Resin Composition, and Liquid Crystal Display Component Thereof or Information Recording Media Component Thereof POLYPLASTICS CO., LTD. (JP) 2009-01-29 US disclosed
EP-1992666-A1 THERMOPLASTIC RESIN COMPOSITION AND LIQUID CRYSTAL DISPLAY PART OR INFORMATION RECORDING MEDIUM PART USING THE COMPOSITION Polyplastics Co., Ltd. (JP) 2008-11-19 EP disclosed