SCHEMBL7794855

SCHEMBL7794855

CCCCCC(C)(C)c1cc(CCC(=O)O)cc(CC)c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.45
THRB P10828 2/20 0.45
TRPV1 Q8NER1 1/20 0.37
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
PTGS2 P35354 1/20 0.35
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2B6 P20813 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL7796629 0.89 THRA (0.46) THRATHRBS1PR4S1PR1S1PR3
SCHEMBL7796634 0.88 THRA (0.45) THRATHRBS1PR4S1PR1S1PR3
SCHEMBL7795937 0.88 THRB (0.44) THRATHRBTRPV1CNR1CNR2
SCHEMBL6565887 0.86 CNR2 (0.37) TRPV1CNR1CNR2PTGS2CYP3A4
SCHEMBL7794852 0.86 THRA (0.40) THRATHRBFFAR1FFAR4
SCHEMBL7796410 0.86 THRA (0.39) THRATHRBFFAR1FFAR4LMNA
SCHEMBL6565867 0.85 PTGS2 (0.39) TRPV1CNR1CNR2PTGS2CYP3A4
SCHEMBL7942504 0.85 CNR2 (0.39) CNR1CNR2
SCHEMBL7794905 0.84 THRA (0.42) THRATHRBTRPV1S1PR4S1PR1
SCHEMBL7792806 0.83 GAA (0.41) THRATHRBFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed