SCHEMBL9558357

SCHEMBL9558357

CC(C)(COCc1ccc(F)c(Oc2ccc(F)cc2)c1)c1ccc(OC(F)(F)Br)cc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.32
PPARG P37231 3/20 0.32
PPARD Q03181 3/20 0.32
LPAR1 Q92633 1/20 0.32
LPAR5 Q9H1C0 1/20 0.32
SLC6A4 P31645 3/20 0.31
CACNA1C Q13936 1/20 0.31
HTR2A P28223 1/20 0.31
KCNH2 Q12809 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A3 Q01959 1/20 0.30
TACR1 P25103 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
NR3C1 P04150 1/20 0.30
APP P05067 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
SCHEMBL9559005 0.93 SLC6A4 (0.38) PPARAPPARGPPARDSLC6A4SLC6A2
SCHEMBL9558563 0.92 TACR1 (0.37) PPARAPPARGPPARDLPAR1LPAR5
SCHEMBL9558511 0.91 PPARA (0.32) PPARAPPARGPPARDLPAR1LPAR5
SCHEMBL9557935 0.91 SLC6A4 (0.37) PPARAPPARGPPARDSLC6A4HTR2A
SCHEMBL9558013 0.88 RAB9A (0.38) LPAR1LPAR5PTGDR2NR3C1
SCHEMBL9558421 0.88 HTR2A (0.41) PPARAPPARGSLC6A4HTR2AKCNH2
SCHEMBL10837314 0.87 HTR2A (0.38) LPAR1LPAR5SLC6A4HTR2ATACR1
SCHEMBL9558493 0.86 CACNA1C (0.44) PPARAPPARGPPARDSLC6A4CACNA1C
SCHEMBL9558208 0.85 SLC6A4 (0.39) PPARGLPAR1LPAR5SLC6A4SLC6A2
SCHEMBL9838121 0.85 LMNA (0.34) PPARAPPARGCACNA1CKCNH2

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-0257415-B1 INSECTICIDAL RESIN COATING FILM MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-31 EP disclosed
US-4997650-A (Meth)acrylonitrile polymer MITSUI TOATSU CHEMICALS, INC. (JP) 1991-03-05 US disclosed
US-4818525-A LONG-LASTING; ACRYLONITRILE COPOLYMER MITSUI TOATSU CHEMICALS, INC. (JP) 1989-04-04 US disclosed
EP-0257415-A1 Insecticidal resin coating film MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-03-02 EP disclosed