SCHEMBL9558334

SCHEMBL9558334

CCCOc1ccc(C(C)(C)COCc2ccc(F)c(Oc3ccc(F)cc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.39
PTPN7 P35236 2/20 0.38
DUSP3 P51452 2/20 0.38
LTA4H P09960 1/20 0.37
PPARA Q07869 5/20 0.37
PPARD Q03181 3/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CACNA1C Q13936 1/20 0.36
CACNA1B Q00975 2/20 0.35
C3AR1 Q16581 1/20 0.35
SCN8A Q9UQD0 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ACACB O00763 1/20 0.35
FAAH O00519 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
SCHEMBL9558298 0.93 LTA4H (0.40) PPARGPTPN7DUSP3LTA4HLMNA
SCHEMBL9558493 0.91 CACNA1C (0.44) PPARGLTA4HPPARAPPARDLMNA
SCHEMBL10835565 0.88 LTA4H (0.46) PPARGLTA4HPPARACACNA1BFAAH
SCHEMBL10835453 0.88 MAPT (0.44) PPARGLTA4HPPARAPPARDLMNA
SCHEMBL9558013 0.86 RAB9A (0.38) LMNASMN1; SMN2L3MBTL1
SCHEMBL9558421 0.86 HTR2A (0.41) PPARGPPARA
SCHEMBL9557935 0.86 SLC6A4 (0.37) PPARGPPARAPPARDLMNACACNA1B
SCHEMBL10837234 0.86 LTA4H (0.48) PPARGLTA4HFAAH
SCHEMBL10837314 0.85 HTR2A (0.38) LTA4HLMNASMN1; SMN2L3MBTL1
SCHEMBL9559005 0.84 SLC6A4 (0.38) PPARGPPARAPPARD

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