SCHEMBL7944737

SCHEMBL7944737

COc1cc(CCC(=O)OCCO)cc(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CNR1 P21554 5/20 0.38
CNR2 P34972 5/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
APP P05067 1/20 0.37
CYP24A1 Q07973 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CALM1 P0DP23 1/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 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
SCHEMBL8433343 0.86 ALDH1A1 (0.41) ALOX5KMT2ATDP1CNR1CNR2
SCHEMBL7933801 0.84 APP (0.41) ALOX5TDP1CNR1CNR2CYP4F2
SCHEMBL7794809 0.80 RXRA (0.54) KMT2ATDP1ALDH1A1CYP24A1LMNA
SCHEMBL10750814 0.80 LMNA (0.51) KMT2ATDP1MAPTALDH1A1CYP24A1
SCHEMBL1792723 0.79 CALM1 (0.40) ALOX5KMT2ATDP1MAPTALDH1A1
SCHEMBL8397561 0.78 ALOX5 (0.43) ALOX5KMT2ATDP1CYP4F2CYP4A11
SCHEMBL1792722 0.78 CALM1 (0.39) ALOX5KMT2ATDP1MAPTALDH1A1
SCHEMBL7943101 0.77 ALOX5 (0.37) ALOX5KMT2ATDP1CYP4F2CYP4A11
SCHEMBL6568817 0.77 PTGS2 (0.49) ALOX5CNR1CNR2CYP4A11CALM1
SCHEMBL8430361 0.76 MGLL (0.37) ALOX5TDP1CNR1CNR2CYP4F2

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