SCHEMBL5207243

SCHEMBL5207243

CCCCCCCCC=Cc1[c]cccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.39
SOAT1 P35610 1/20 0.39
CYSLTR2 Q9NS75 2/20 0.38
CYSLTR1 Q9Y271 2/20 0.38
FAAH O00519 4/20 0.38
EPHX2 P34913 3/20 0.38
TRPV1 Q8NER1 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
TNNC1 P63316 1/20 0.36
OXER1 Q8TDS5 1/20 0.36
MGLL Q99685 1/20 0.35
HTT P42858 1/20 0.35
CCR5 P51681 1/20 0.35

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
SCHEMBL11128564 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5207710 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5206585 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5209893 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5204831 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5206578 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5204821 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5207912 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5207403 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH
SCHEMBL5206592 1.00 SOAT2 (0.39) SOAT2SOAT1CYSLTR2CYSLTR1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980867-B1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES (JP) 2007-08-08 EP disclosed
US-6100292-A Ketone derivatives and their medical applications TORAY INDUSTRIES, INC. (JP) 2000-08-08 US disclosed
EP-0980867-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2000-02-23 EP disclosed
US-4251350-A Hydrocarbon hydrotreating process ATLANTIC RICHFIELD COMPANY (US) 1981-02-17 US disclosed
US-3932270-A NICKEL ATLANTIC RICHFIELD COMPANY (US) 1976-01-13 US disclosed