SCHEMBL8568530

SCHEMBL8568530

FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.50
HRH4 Q9H3N8 1/20 0.37
DUT P33316 1/20 0.35
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
TK2 O00142 6/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 1/20 0.33
SLC6A1 P30531 1/20 0.33
TK1 P04183 1/20 0.33

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
SCHEMBL8572871 1.00 KIF11 (0.50) KIF11HRH4DUTTSHRALDH1A1
SCHEMBL8571770 0.98 KIF11 (0.52) KIF11HRH4DUTTSHRALDH1A1
SCHEMBL8569418 0.85 KIF11 (0.46) KIF11HRH4DUTTK2TK1
SCHEMBL6968793 0.79 KIF11 (0.36) KIF11DUTTK1
SCHEMBL6968794 0.79 KIF11 (0.36) KIF11DUTTK1
SCHEMBL18997009 0.77 KCNA3 (0.47) ALDH1A1
SCHEMBL8717884 0.75 KIF11 (0.49) KIF11HRH4DUTTK2TK1
SCHEMBL19753880 0.74 CES1 (0.56) ALDH1A1
SCHEMBL11275984 0.74 KIF11 (0.74) KIF11HRH4DUTTSHRALDH1A1
SCHEMBL24080681 0.74 KIF11 (0.52) KIF11HRH4DUTTSHRALDH1A1

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-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 US disclosed