SCHEMBL29547545

SCHEMBL29547545

O=C(O)C1CCN(c2ccc3c(=O)c4cccc(F)c4oc3c2)C1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 18/20 0.50
▸ TTR P02766 1/20 0.42

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
SCHEMBL19641810 1.00 NOTUM (0.50) NOTUMTTR
SCHEMBL19662117 0.89 NOTUM (0.56) NOTUMTTR
SCHEMBL19662652 0.89 NOTUM (0.56) NOTUMTTR
SCHEMBL29548036 0.89 NOTUM (0.56) NOTUMTTR
SCHEMBL19642435 0.89 NOTUM (0.56) NOTUMTTR
SCHEMBL19642429 0.88 HSD11B1 (0.40) NOTUMTTR
SCHEMBL29547630 0.88 HSD11B1 (0.40) NOTUMTTR
SCHEMBL19642423 0.88 NOTUM (0.49) NOTUMTTR
SCHEMBL29547637 0.88 NOTUM (0.49) NOTUMTTR
SCHEMBL19642375 0.87 NOTUM (0.55) NOTUM

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
CN-109311860-B Xanthone derivatives for the treatment or prevention of hepatitis B virus diseases 豪夫迈·罗氏有限公司 2022-04-08 — — CN claimed
CN-109311860-B Xanthone derivatives for the treatment or prevention of hepatitis B virus diseases 豪夫迈·罗氏有限公司 2022-04-08 — — CN disclosed
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