SCHEMBL7941368

SCHEMBL7941368

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 4/20 0.39
ALOX5 P09917 1/20 0.39
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
ABCB1 P08183 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
ATM Q13315 1/20 0.34
S1PR1 P21453 1/20 0.34
PTGDR2 Q9Y5Y4 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
SCHEMBL8433312 0.90 L3MBTL1 (0.44) ALDH1A1KMT2AALOX5POLBL3MBTL1
SCHEMBL7933549 0.88 ALDH1A1 (0.47) ALDH1A1KMT2AALOX5CYP4F2CYP4A11
SCHEMBL7944855 0.86 ALOX5 (0.40) ALDH1A1KMT2AALOX5CYP4F2CYP4A11
SCHEMBL6568830 0.86 ALDH1A1 (0.38) ALDH1A1SIGMAR1POLBPTGDR2
SCHEMBL7941423 0.86 ALDH1A1 (0.46) ALDH1A1KMT2AALOX5ABCB1SIGMAR1
SCHEMBL7794938 0.85 THRA (0.47) ALDH1A1KMT2AABCB1SIGMAR1MEN1
SCHEMBL6567755 0.83 TNKS2 (0.40) ALDH1A1PTGDR2
SCHEMBL7944751 0.81 THRB (0.39) ALDH1A1KMT2AMEN1PTGDR2
SCHEMBL7941422 0.80 MEN1 (0.50) ALDH1A1KMT2AALOX5CYP4F2CYP4A11
SCHEMBL7941069 0.78 ALDH1A1 (0.37) ALDH1A1KMT2AALOX5CYP4F2CYP4A11

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