SCHEMBL6556987

SCHEMBL6556987

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nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.55
MAPT P10636 1/20 0.46
GABRR1 P24046 2/20 0.46
LMNA P02545 1/20 0.46
GPR84 Q9NQS5 4/20 0.42
PGD P52209 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
HMGCR P04035 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
ADRA1A P35348 1/20 0.39
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL3188147 0.83 SLC22A6 (0.57) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL607504 0.83 SLC22A6 (0.57) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL18538667 0.83 SLC22A6 (0.57) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL26138089 0.73 SLC22A6 (0.75) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL3409902 0.73 SLC22A6 (0.50) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL112368 0.73 SLC22A6 (1.00) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL30496763 0.73 SLC22A6 (1.00) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL9854587 0.71 SLC22A6 (0.55) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL3089526 0.71 SLC22A6 (0.71) SLC22A6MAPTGABRR1LMNAGPR84
SCHEMBL6733935 0.70 SLC22A6 (0.93) SLC22A6MAPTGABRR1LMNAGPR84

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
EP-1184380-B1 Ammonium 3,5,6-trihydroxyhexanoate derivatives and preparation process thereof TAKASAGO PERFUMERY CO LTD (JP) 2004-02-25 EP disclosed