SCHEMBL8718985

SCHEMBL8718985

CCCCOB(OCCCC)OC(c1ccccc1)(c1ccccc1)C(CC)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.36
PCSK9 Q8NBP7 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8714757 0.87
SCHEMBL8717893 0.86 TSHR (0.33) TSHR
SCHEMBL8718549 0.82 CYP3A4 (0.33) CYP2C9CYP2C19
SCHEMBL8719828 0.81 KCNN4 (0.30)
SCHEMBL8718928 0.78
SCHEMBL8720702 0.76 L3MBTL1 (0.31) LTA4HL3MBTL1
SCHEMBL8715254 0.76 LTA4H (0.30) LTA4H
SCHEMBL9717859 0.74 CYP2C19 (0.35) PCSK9CYP1A2CYP2C19MEN1KMT2A
SCHEMBL14675113 0.68 LTA4H (0.37) LTA4HPCSK9TSHR
SCHEMBL8022872 0.67 LTA4H (0.53) LTA4HPCSK9CYP1A2CYP2C9CYP2C19

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