SCHEMBL9558201

SCHEMBL9558201

CCOc1ccc(C2(CCCc3ccc(F)c(Oc4ccccc4)c3)CC2(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.39
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
LPAR1 Q92633 6/20 0.35
LPAR5 Q9H1C0 6/20 0.35
SIGMAR1 Q99720 2/20 0.34
CACNA1C Q13936 1/20 0.34
ADORA3 P0DMS8 1/20 0.33
HTR2A P28223 1/20 0.33
HTR7 P34969 1/20 0.33
OPRM1 P35372 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9558426 0.92 LTA4H (0.39) LTA4HSLC6A2SLC6A4SLC6A3LPAR1
SCHEMBL9558575 0.86 LTA4H (0.41) LTA4HSLC6A2SLC6A4SLC6A3LPAR1
SCHEMBL9558726 0.85 LTA4H (0.39) LTA4HSLC6A2SLC6A4SLC6A3LPAR1
SCHEMBL9558012 0.85 CACNA1C (0.39) SLC6A2SLC6A4SLC6A3LPAR1LPAR5
SCHEMBL9558634 0.84 LTA4H (0.47) LTA4HSIGMAR1TDP1
SCHEMBL10550785 0.84 LTA4H (0.39) LTA4HSLC6A2SLC6A4SLC6A3LPAR1
SCHEMBL9558579 0.84 LTA4H (0.39) LTA4HSLC6A2SLC6A4SLC6A3LPAR1
SCHEMBL10547558 0.83 LTA4H (0.39) LTA4HSLC6A2SLC6A4SLC6A3SIGMAR1
SCHEMBL10809728 0.82 L3MBTL1 (0.34) SLC6A4LPAR1LPAR5HTR2APPARG
SCHEMBL10808624 0.82 LPAR1 (0.39) LTA4HLPAR1LPAR5SIGMAR1

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