SCHEMBL7941367

SCHEMBL7941367

CC(C)(C)c1cc(COCCCO)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
ALOX15 P16050 4/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
CYP2C9 P11712 2/20 0.47
NR1I2 O75469 1/20 0.47
MIF P14174 1/20 0.47
TYR P14679 1/20 0.47
NFE2L2 Q16236 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CYP1A2 P05177 2/20 0.37
ATP2A2 P16615 1/20 0.37
ATP2A3 Q93084 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
ATM Q13315 3/20 0.36

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
SCHEMBL7933921 0.95 ALDH1A1 (0.46) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL7940444 0.91 ALDH1A1 (0.50) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL7941099 0.83 ALDH1A1 (0.49) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL11809725 0.81 ALDH1A1 (0.53) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL2913386 0.79 ALOX15 (0.50) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL7941416 0.78 ALDH1A1 (0.47) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL7933787 0.78 CYP1A2 (0.45) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL6416102 0.78 ALOX15 (0.50) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL2564784 0.77 ALDH1A1 (0.57) ALDH1A1ALOX15LMNAHTTCYP2C9
SCHEMBL7942551 0.77 DHFR (0.38) ALDH1A1ALOX15LMNAHTTCYP2C9

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-5874494-A DETERIORATION STABILIZER FOR THERMOPLASTIC RESIN; OXIDATION RESISTANCE, DISCOLORATION INHIBITION, HEAT RESISTANCE, CROSSLINKING INHIBITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-23 US disclosed