SCHEMBL9873185

SCHEMBL9873185

CC1(C)Cc2cc(C(=O)C(F)(F)C(F)(F)F)ccc2O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
SSTR5 P35346 1/20 0.37
RXRA P19793 1/20 0.36
HTR2A P28223 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
AKR1B1 P15121 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
HPGD P15428 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
POLB P06746 1/20 0.33
HIF1A Q16665 2/20 0.32
EPAS1 Q99814 2/20 0.32
PPARA Q07869 1/20 0.32
COXFA4 O00483 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
SCHEMBL10407993 0.81 MAPT (0.44) MAPTSSTR5RXRAHTR2AALDH1A1
SCHEMBL103150 0.79 MAPT (0.47) MAPTSSTR5RXRAALDH1A1KDM4E
SCHEMBL2812534 0.79 RXRA (0.52) MAPTSSTR5RXRAALDH1A1KDM4E
SCHEMBL15947259 0.75 MAPT (0.47) MAPTSSTR5ALDH1A1KDM4EHPGD
SCHEMBL2811130 0.72 CA12 (0.48) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9139474 0.72 ACHE (0.37) RXRAKDM4EPPARA
SCHEMBL4734952 0.72 MAOB (0.40) MAPTSSTR5RXRAHTR2AALDH1A1
SCHEMBL9139473 0.72 ACHE (0.37) RXRAKDM4EPPARA
SCHEMBL31417710 0.71 MAOB (0.34) MAPTSSTR5RXRAHTR2AALDH1A1
SCHEMBL31417828 0.71 MAOB (0.34) MAPTSSTR5RXRAHTR2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5008277-A For controlling insects in agriculture FMC CORPORATION (US) 1991-04-16 US disclosed
US-4870089-A N-[(alpha-perhaloalkylbenzyloxy)pyridyl]-N'-benzoylurea insecticides FMC CORPORATION (US) 1989-09-26 US disclosed