SCHEMBL9723110

SCHEMBL9723110

Fc1cc(F)cc(Oc2ccc(OCCCBr)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 8/20 0.42
FFAR4 Q5NUL3 3/20 0.39
PLA2G2A P14555 1/20 0.38
CACNA1B Q00975 2/20 0.37
FFAR1 O14842 2/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL9713602 0.91 LTA4H (0.42) LTA4HFFAR4PLA2G2A
SCHEMBL3064784 0.85 SOD1 (0.39) DRD2DRD4DRD3
SCHEMBL1427333 0.81 DRD2 (0.50) LTA4HDRD2DRD4DRD3
SCHEMBL9713406 0.80 ALDH1A1 (0.48) LTA4HFFAR4PLA2G2AFFAR1
SCHEMBL9459574 0.80 PPARA (0.48) FFAR4FFAR1
SCHEMBL7823301 0.79 SOD1 (0.38) PLA2G2A
SCHEMBL2530176 0.78 KCNA3 (0.50) LTA4HDRD2DRD4DRD3
SCHEMBL10715281 0.78 VEGFA (0.46) LTA4HFFAR4FFAR1
SCHEMBL5375466 0.77 LTA4H (0.68) LTA4HPLA2G2ADRD2DRD4DRD3
Alcohol SCHEMBL10452214 0.76 NR1I2 (0.49) LTA4HFFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5137907-A Pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-08-11 US disclosed