SCHEMBL7796629

SCHEMBL7796629

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

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.46
THRB P10828 2/20 0.46
GAA P10253 2/20 0.39
KMT2A Q03164 1/20 0.39
TNFRSF1A P19438 1/20 0.38
S1PR4 O95977 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
FFAR1 O14842 2/20 0.36
FFAR4 Q5NUL3 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
PTGS2 P35354 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL7796634 0.89 THRA (0.45) THRATHRBS1PR4S1PR1S1PR3
SCHEMBL7794855 0.89 THRA (0.45) THRATHRBS1PR4S1PR1S1PR3
SCHEMBL7786486 0.88 THRB (0.45) THRATHRBTNFRSF1ACNR1CNR2
SCHEMBL7792487 0.86 GAA (0.40) THRATHRBGAAKMT2ATNFRSF1A
SCHEMBL7796603 0.85 GAA (0.45) THRATHRBGAAKMT2ATNFRSF1A
SCHEMBL6565810 0.85 PTGS2 (0.38) TNFRSF1ACNR1CNR2PTGS2
SCHEMBL7796625 0.85 GAA (0.39) THRATHRBGAAKMT2ATNFRSF1A
SCHEMBL7944896 0.84 CNR2 (0.39) GAAKMT2ACNR1CNR2
SCHEMBL7796447 0.84 GAA (0.53) THRATHRBGAAKMT2ARXRA
SCHEMBL6568783 0.84 PTGS2 (0.40) CNR1CNR2PTGS2

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