SCHEMBL8714858

SCHEMBL8714858

BrC(Br)(Br)C(Br)(Br)CCCCCCOC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.52
HRH4 Q9H3N8 1/20 0.44
TK2 O00142 11/20 0.44
TK1 P04183 1/20 0.42
DUT P33316 1/20 0.36
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
KCNA3 P22001 1/20 0.33
SLC6A1 P30531 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
SCHEMBL8573627 0.92 KIF11 (0.47) KIF11HRH4TK2TK1DUT
SCHEMBL20032419 0.81 KIF11 (0.55) KIF11HRH4TK2TK1DUT
SCHEMBL913220 0.81 KIF11 (0.55) KIF11HRH4TK2TK1DUT
SCHEMBL17377651 0.81 KIF11 (0.55) KIF11HRH4TK2TK1DUT
SCHEMBL4008546 0.79 KIF11 (0.57) KIF11HRH4TK2TK1DUT
SCHEMBL8718031 0.79 KIF11 (0.49) KIF11HRH4TK2TK1DUT
SCHEMBL8717884 0.79 KIF11 (0.49) KIF11HRH4TK2TK1DUT
SCHEMBL25077100 0.78 KIF11 (0.55) KIF11HRH4TK2TK1TSHR
SCHEMBL9637348 0.78 KIF11 (0.55) KIF11HRH4TK2TK1DUT
SCHEMBL914263 0.78 KIF11 (0.55) KIF11HRH4TK2TK1DUT

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
US-5744678-A NICKEL COMPOUND, ORGANOPHOSPHORUS COMPOUND, ORGANOALUMINUM COMPOUND, CARBON-HALOGEN COMPOUNDS; CATALYST SELECTIVITY NIPPON OIL CO., LTD. (JP) 1998-04-28 US disclosed
EP-0758563-A1 OLEFIN OLIGOMERIZATION CATALYST AND PROCESS FOR THE PREPARATION OF OLEFIN OLIGOMER USING IT NIPPON OIL COMPANY, LTD. (JP) 1997-02-19 EP disclosed