SCHEMBL8203554

SCHEMBL8203554

CCOC(=O)[N]C1CC1(F)F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
TRPA1 O75762 1/20 0.34
LMNA P02545 3/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX15 P16050 2/20 0.32
GAA P10253 2/20 0.32
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
GRM1 Q13255 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL7470478 0.71
SCHEMBL8396639 0.68 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10ALOX15GAA
SCHEMBL7476610 0.68 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10ALOX15GAA
SCHEMBL8393516 0.67 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10GAAKDM4E
SCHEMBL7476407 0.67 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10GAAKDM4E
SCHEMBL4644488 0.65
SCHEMBL421928 0.65
SCHEMBL17075156 0.64 ALDH1A1 (0.40) ALDH1A1TRPA1LMNAHSD17B10GAA
SCHEMBL3528154 0.64 GAA (0.50) ALDH1A1TRPA1LMNAALOX15GAA
SCHEMBL883977 0.64 SLC6A2 (0.36) ALDH1A1LMNAHSD17B10ALOX15GAA

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-6017931-A Insecticidal compositions containing n-(substituted phenylmethyl)-4-[bis(substituted phenyl)methyl]piperidines FMC CORPORATION 2000-01-25 US disclosed