SCHEMBL7794905

SCHEMBL7794905

CCCCCC(C)(C)c1cc(CCC(=O)O)cc(CC)c1O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
GAA P10253 2/20 0.40
KMT2A Q03164 1/20 0.40
HSPA5 P11021 1/20 0.38
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
AKR1B1 P15121 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
SCHEMBL8405268 0.94 THRA (0.41) THRATHRBGAAKMT2AHSPA5
SCHEMBL5929167 0.92 GAA (0.47) THRATHRBGAAKMT2AFFAR1
SCHEMBL7796447 0.88 GAA (0.53) THRATHRBGAAKMT2ARXRA
SCHEMBL7794928 0.87 THRA (0.42) THRATHRBGAAKMT2AFFAR1
SCHEMBL7792635 0.87 ALDH1A1 (0.41) THRATHRBHSPA5TRPV1
SCHEMBL7942304 0.85 HSPA5 (0.41) THRATHRBGAAKMT2AHSPA5
SCHEMBL3805394 0.85 HSPA5 (0.41) GAAKMT2AHSPA5
SCHEMBL7796395 0.85 HSPA5 (0.43) THRATHRBGAAKMT2AHSPA5
SCHEMBL2917132 0.84 HSPA5 (0.40) GAAKMT2AHSPA5
SCHEMBL7794855 0.84 THRA (0.45) THRATHRBFFAR1FFAR4TRPV1

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 4 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
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed