SCHEMBL9558563

SCHEMBL9558563

CC(C)(COCc1ccc(F)c(Oc2ccccc2)c1)c1ccc(OC(F)(F)Br)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.37
PPARG P37231 4/20 0.36
LPAR1 Q92633 3/20 0.35
LPAR5 Q9H1C0 3/20 0.35
TTR P02766 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 1/20 0.33
RAB9A P51151 1/20 0.33
MAPK14 Q16539 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 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
SCHEMBL9558208 0.93 SLC6A4 (0.39) TACR1PPARGLPAR1LPAR5TTR
SCHEMBL9558357 0.92 PPARA (0.32) TACR1PPARGLPAR1LPAR5SLC6A2
SCHEMBL10837117 0.92 NPC1 (0.38) TACR1PPARGLPAR1LPAR5TTR
SCHEMBL10836475 0.91 TTR (0.38) TACR1PPARGLPAR1LPAR5TTR
SCHEMBL10835647 0.91 TACR1 (0.36) TACR1PPARGLPAR1LPAR5TTR
SCHEMBL9558183 0.91 TACR1 (0.36) TACR1PPARGLPAR1LPAR5TTR
SCHEMBL10836610 0.90 CETP (0.37) TACR1PPARGLPAR1LPAR5
SCHEMBL9558410 0.90 TACR1 (0.44) TACR1PPARGLPAR1LPAR5TTR
SCHEMBL10837667 0.90 TACR1 (0.42) TACR1LPAR1LPAR5TTRFFAR4
SCHEMBL10837106 0.89 TACR1 (0.34) TACR1PPARGLPAR1LPAR5TTR

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-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
US-4782094-A Difluorobromomethoxyphenyl derivative and miticide comprising said derivative as active ingredient MITSUI TOATSU CHEMICALS, INC. (JP) 1988-11-01 US disclosed
EP-0257415-A1 Insecticidal resin coating film MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-03-02 EP disclosed