SCHEMBL7796633

SCHEMBL7796633

COc1c(C)cc(CCC(=O)O)cc1C(C)(C)CC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 9/20 0.41
FFAR1 O14842 4/20 0.41
THRA P10827 3/20 0.38
THRB P10828 3/20 0.38
FFAR2 O15552 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 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
SCHEMBL7796625 0.88 GAA (0.39) FFAR4FFAR1THRATHRBKMT2A
SCHEMBL7792867 0.88 FFAR4 (0.41) FFAR4FFAR1THRATHRBFFAR2
SCHEMBL7795884 0.86 THRB (0.37) THRATHRBALDH1A1RXRA
SCHEMBL7792155 0.86 FFAR1 (0.44) FFAR4FFAR1THRATHRBFFAR2
SCHEMBL7794852 0.86 THRA (0.40) FFAR4FFAR1THRATHRBKMT2A
SCHEMBL7796634 0.85 THRA (0.45) FFAR4FFAR1THRATHRBFFAR2
SCHEMBL6567275 0.83 TNKS2 (0.33) LMNA
SCHEMBL7933767 0.83 ALDH1A1 (0.41) KMT2ALMNAALDH1A1
SCHEMBL3669296 0.83 NPSR1 (0.52) FFAR4FFAR1THRATHRBNPSR1
SCHEMBL7794926 0.82 GAA (0.40) FFAR4FFAR1THRATHRBNPSR1

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