SCHEMBL8410609

SCHEMBL8410609

CC(C)(C)c1cc(CN(CCCO)CCCO)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.60
MAPT P10636 4/20 0.60
KDM4E B2RXH2 3/20 0.60
HTT P42858 2/20 0.60
MAPK1 P28482 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
HPGD P15428 2/20 0.60
LMNA P02545 4/20 0.43
ALOX15 P16050 3/20 0.43
CYP2C9 P11712 3/20 0.43
NR1I2 O75469 1/20 0.43
MIF P14174 1/20 0.43
TYR P14679 1/20 0.43
NFE2L2 Q16236 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 2/20 0.43
TSHR P16473 4/20 0.42
GAA P10253 3/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42

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
SCHEMBL8408085 0.95 ALDH1A1 (0.59) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL8410852 0.91 ALDH1A1 (0.73) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL8407894 0.86 ALDH1A1 (0.81) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL7941155 0.84 ALDH1A1 (0.63) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL8407759 0.81 ALDH1A1 (0.79) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL7943222 0.80 ALDH1A1 (0.54) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL2913386 0.79 ALOX15 (0.50) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL7943159 0.79 ALDH1A1 (0.53) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL8409980 0.78 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EHTTMAPK1
SCHEMBL6416102 0.78 ALOX15 (0.50) ALDH1A1MAPTKDM4EHTTSMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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