SCHEMBL7941331

SCHEMBL7941331

CCc1cc(CCC(=O)O)cc(C2(C)CCCCC2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
CYP26B1 Q9NR63 4/20 0.43
CYP26A1 O43174 3/20 0.43
NPSR1 Q6W5P4 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP3A4 P08684 1/20 0.39
RARB P10826 3/20 0.38
RARG P13631 3/20 0.38
PTGDR Q13258 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
RXRA P19793 1/20 0.35
THRA P10827 3/20 0.35
THRB P10828 3/20 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
SCHEMBL7940089 0.86 TSHR (0.46) GLATSHRALOX12CYP26B1CYP26A1
SCHEMBL7796455 0.85 CYP26B1 (0.44) GLATSHRALOX12CYP26B1CYP26A1
SCHEMBL3808966 0.85 GLA (0.47) GLATSHRALOX12NPSR1MEN1
SCHEMBL7796429 0.84 CYP26B1 (0.41) CYP26B1CYP26A1CYP3A4RARBRARG
SCHEMBL2916191 0.83 GLA (0.45) GLATSHRALOX12NPSR1MEN1
SCHEMBL7941462 0.82 GLA (0.39) GLATSHRALOX12NPSR1MEN1
SCHEMBL7792145 0.82 GAA (0.45) GLATSHRALOX12CYP26B1CYP26A1
SCHEMBL7796128 0.80 CYP26B1 (0.52) CYP26B1CYP26A1CYP3A4RARBRARG
SCHEMBL7786437 0.78 RARB (0.48) GLATSHRALOX12NPSR1MEN1
SCHEMBL18554686 0.78 NPSR1 (0.48) NPSR1RXRATHRATHRBFFAR1

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-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