SCHEMBL7796573

SCHEMBL7796573

CCc1cc(CC(=O)O)cc(C2CCCCC2)c1OC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.46
PTGDR2 Q9Y5Y4 11/20 0.46
THRA P10827 2/20 0.45
PTGDR Q13258 5/20 0.40
PTGER2 P43116 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
CCNT1 O60563 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL7794938 0.87 THRA (0.47) THRBPTGDR2THRAALDH1A1SIGMAR1
SCHEMBL7792920 0.85 THRB (0.49) THRBPTGDR2THRAPTGDRPTGER2
SCHEMBL8433312 0.83 L3MBTL1 (0.44) PTGDR2PTGDRL3MBTL1CCNT1CCNE1
SCHEMBL7786559 0.83 THRB (0.46) THRBPTGDR2THRAPTGDRPTGER2
SCHEMBL6568830 0.83 ALDH1A1 (0.38) PTGDR2PTGDRALDH1A1TDP1SIGMAR1
SCHEMBL7795915 0.82 THRB (0.46) THRBPTGDR2THRAPTGDRPTGER2
SCHEMBL7796140 0.81 PTGDR2 (0.42) PTGDR2PTGDRTDP1
SCHEMBL6567755 0.81 TNKS2 (0.40) PTGDR2ALDH1A1
SCHEMBL7941368 0.77 ALDH1A1 (0.47) PTGDR2L3MBTL1ALDH1A1SIGMAR1
SCHEMBL14581905 0.77 PTGDR2 (0.42) THRBPTGDR2PTGDRPTGER2ALDH1A1

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