SCHEMBL11037568

SCHEMBL11037568

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nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
CYP2C9 P11712 1/20 0.42
PDE4A P27815 1/20 0.42
ALDH1A1 P00352 1/20 0.32
TP53 P04637 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
SCHEMBL29624067 1.00 TSHR (0.47) TSHRCYP2C9PDE4AALDH1A1TP53
SCHEMBL29361583 1.00 TSHR (0.47) TSHRCYP2C9PDE4AALDH1A1TP53
SCHEMBL14038079 1.00 TSHR (0.47) TSHRCYP2C9PDE4AALDH1A1TP53
SCHEMBL29424095 1.00 TSHR (0.47) TSHRCYP2C9PDE4AALDH1A1TP53
SCHEMBL29623845 1.00 TSHR (0.47) TSHRCYP2C9PDE4AALDH1A1TP53
Glucuronic Acid SCHEMBL23929292 0.92 PDE4A (0.46) TSHRCYP2C9PDE4AALDH1A1TP53
Glucuronic Acid SCHEMBL23929291 0.92 PDE4A (0.46) TSHRCYP2C9PDE4AALDH1A1TP53
Mucic Acid SCHEMBL23388836 0.92 PDE4A (0.46) TSHRCYP2C9PDE4AALDH1A1TP53
Glucuronic Acid SCHEMBL5974 0.92 PDE4A (0.46) TSHRCYP2C9PDE4AALDH1A1TP53
Glucuronic Acid SCHEMBL2559030 0.92 PDE4A (0.46) TSHRCYP2C9PDE4AALDH1A1TP53

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-0153095-A1 A process for procuding 5-doxy-L-arabinose SUNTORY LIMITED (JP) 1985-08-28 EP disclosed