SCHEMBL7942500

SCHEMBL7942500

CCc1cc(CCC(=O)OCCO)cc(C(C)(C)CC(C)(C)C)c1OC

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
ALOX5 P09917 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
ALDH1A1 P00352 4/20 0.34
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MGLL Q99685 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
S1PR1 P21453 1/20 0.33
NTRK1 P04629 1/20 0.33
APP P05067 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL7942509 0.91 KMT2A (0.39) KMT2AALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL7944894 0.89 ALOX5 (0.38) KMT2AALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL7942652 0.89 KMT2A (0.40) KMT2AALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL7942504 0.88 CNR2 (0.39) KMT2AALOX5MGLL
SCHEMBL7933767 0.88 ALDH1A1 (0.41) KMT2AALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL7943346 0.86 ALOX5 (0.38) KMT2AALOX5CYP4F2CYP4A11TDP1
SCHEMBL6565884 0.84 MAPT (0.35) CYP4F2CYP4A11MAPTCYP3A4SMN1; SMN2
SCHEMBL7794852 0.83 THRA (0.40) KMT2A
SCHEMBL6565863 0.83 TNKS2 (0.39) CYP4F2CYP4A11MAPTCYP3A4SMN1; SMN2
SCHEMBL7940250 0.81 ALOX5 (0.39) KMT2AALOX5CYP4F2CYP4A11ALDH1A1

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