SCHEMBL10898897

SCHEMBL10898897

CC(=O)OC1=C(c2ccccc2C)C(=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 2/20 0.41
▸ PKM P14618 2/20 0.38
▸ KDM4E B2RXH2 5/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HIF1A Q16665 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HTT P42858 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ KIF11 P52732 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CES1 P23141 1/20 0.34
▸ PTAFR P25105 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PREP P48147 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
SCHEMBL10898696 0.83 LMNA (0.39) NOTUMKDM4EALDH1A1MAPTMEN1
SCHEMBL11089293 0.71 HSP90AA1 (0.42) NOTUMALDH1A1HSD17B10MAPTMEN1
SCHEMBL27536958 0.69 LMNA (0.34) GAA
SCHEMBL5280480 0.68 KDM4E (0.52) PKMKDM4EALDH1A1HSD17B10HPGD
SCHEMBL6901954 0.68 PPARG (0.54) PKMKDM4EALDH1A1MAPTMEN1
SCHEMBL11094467 0.67 ALDH1A1 (0.38) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11092965 0.67 SMN1; SMN2 (0.44) SMN1; SMN2
SCHEMBL11094856 0.66 KMT2A (0.40) ALDH1A1HSD17B10MEN1KMT2AGAA
SCHEMBL1551128 0.66 LMNA (0.55) PKMALDH1A1HSD17B10MAPTMEN1
SCHEMBL885365 0.65 PREP (0.35) PREP

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-4632698-A MITICIDES; HERBICIDES UNION CARBIDE CORPORATION (US) 1986-12-30 — — US disclosed
US-4551547-A HERBICIDES UNION CARBIDE CORPORATION (US) 1985-11-05 — — US disclosed
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