SCHEMBL7944751

SCHEMBL7944751

CCc1cc(C(=O)OCCO)cc(C2CCCCC2)c1OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.39
SLC29A1 Q99808 6/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
THPO P40225 2/20 0.37
MTOR P42345 2/20 0.37
SCN1A P35498 2/20 0.37
SCN2A Q99250 2/20 0.37
SCN3A Q9NY46 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
ABCC4 O15439 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
CHRM3 P20309 1/20 0.37
HTR2A P28223 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
SCHEMBL7942538 0.87 THRB (0.39) THRBSLC29A1SMN1; SMN2KMT2AMEN1
SCHEMBL7942514 0.85 ESR1 (0.39) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL7944907 0.85 THRB (0.38) THRBSLC29A1SMN1; SMN2KMT2AMEN1
SCHEMBL7796140 0.82 PTGDR2 (0.42) KMT2AHTR2APTGDR2TDP1
SCHEMBL8433312 0.81 L3MBTL1 (0.44) SMN1; SMN2KMT2AMEN1ALDH1A1CYP2C9
SCHEMBL7941368 0.81 ALDH1A1 (0.47) KMT2AMEN1ALDH1A1PTGDR2
SCHEMBL7944788 0.78 PTGDR2 (0.47) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL7941148 0.77 ESR1 (0.48) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL6568830 0.76 ALDH1A1 (0.38) ALDH1A1MAPTHTR2APTGDR2TDP1
SCHEMBL14581905 0.76 PTGDR2 (0.42) THRBKMT2AMEN1ALDH1A1PTGDR2

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 3 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
US-5891939-A POLYMER STABILIZERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-04-06 US disclosed