SCHEMBL6232748

SCHEMBL6232748

CCCCc1c(F)ccc(O)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
HTT P42858 2/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALOX5 P09917 5/20 0.44
TYR P14679 3/20 0.43
KDM4E B2RXH2 2/20 0.39
PKM P14618 1/20 0.39
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL23491275 0.88 HPGD (0.44) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL6230815 0.88 CNR1 (0.39) HPGDALOX5TYRKDM4EALDH1A1
SCHEMBL9904912 0.86 HTT (0.47) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL7544746 0.84 HPGD (0.52) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL27826421 0.81 HTT (0.43) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL4955648 0.80 HPGD (0.48) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL887689 0.78 TYR (0.58) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL6280911 0.78 TYR (0.56) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5921665 0.77 HPGD (0.46) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5680553 0.77 TYR (0.51) HPGDHTTNPC1MAPK1RAB9A

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
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed