SCHEMBL8528720

SCHEMBL8528720

CCCCCCC=Cc1ccc2c(c1C=CCCCCCC)Cc1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.44
CYSLTR1 Q9Y271 2/20 0.44
PNMT P11086 1/20 0.35
SOAT2 O75908 1/20 0.35
SOAT1 P35610 1/20 0.35
CCR5 P51681 6/20 0.34
FAAH O00519 4/20 0.34
EPHX2 P34913 2/20 0.34
DAGLA Q9Y4D2 1/20 0.33
CES1 P23141 1/20 0.33
SLC37A4 O43826 1/20 0.33
OXER1 Q8TDS5 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 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
SCHEMBL8528717 1.00 CYSLTR2 (0.44) CYSLTR2CYSLTR1PNMTSOAT2SOAT1
SCHEMBL3677224 0.87 CYSLTR2 (0.37) CYSLTR2CYSLTR1PNMT
SCHEMBL30004330 0.85 PNMT (0.40) PNMT
SCHEMBL27762485 0.80 PNMT (0.43) CYSLTR2CYSLTR1PNMTOXER1
SCHEMBL28655660 0.72 CYP2D6 (0.35) PNMTCNR1
SCHEMBL14109745 0.72 CYP2D6 (0.35) PNMTCNR1
Fluorene SCHEMBL28135016 0.72 ALDH1A1 (0.50) PNMTSOAT1
Fluorene SCHEMBL27803639 0.72 ALDH1A1 (0.50) PNMTSOAT1
Alcohol SCHEMBL30689895 0.71 RAB9A (0.39) PNMT
SCHEMBL1617413 0.71 CYP1A2 (0.43) PNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0574370-B1 Metallocene catalyst component with good catalyst efficiency after aging FINA TECHNOLOGY (US) 1998-03-11 EP disclosed
US-5449651-A Metallocene compound for a catalyst component with good catalyst efficiency after aging FINA TECHNOLOGY, INC. (US) 1995-09-12 US disclosed
US-5308817-A Containing polymerizable functional group, syndiotactic polymers, olefin polymerization FINA TECHNOLOGY, INC. (US) 1994-05-03 US disclosed
EP-0574370-A1 Metallocene catalyst component with good catalyst efficiency after aging FINA TECHNOLOGY, INC. (US) 1993-12-15 EP disclosed