SCHEMBL5596207

SCHEMBL5596207

CC(C)(C)c1ccc(O)c(C(C)(P)c2cc(C(C)(C)C)ccc2O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
ALOX15 P16050 3/20 0.59
HSD17B10 Q99714 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
HPGD P15428 1/20 0.59
MAPT P10636 4/20 0.53
MEN1 O00255 2/20 0.53
GAA P10253 2/20 0.53
PKM P14618 2/20 0.53
KMT2A Q03164 2/20 0.53
RECQL P46063 1/20 0.53
LMNA P02545 2/20 0.47
TYR P14679 2/20 0.47
NR1I2 O75469 1/20 0.47
CYP2C9 P11712 1/20 0.47
MIF P14174 1/20 0.47
HTT P42858 1/20 0.47
NFE2L2 Q16236 1/20 0.47
CYP2D6 P10635 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46

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
SCHEMBL109921 0.85 ALDH1A1 (0.67) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29364103 0.85 ALDH1A1 (0.67) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL28420832 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
Fluoride SCHEMBL29290988 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29851227 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
Hydrochloric Acid SCHEMBL4359705 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL30621342 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL13412020 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL3859151 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29614756 0.83 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD

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-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed