SCHEMBL29548215

SCHEMBL29548215

O=c1c2ccc(N3CCCC(O)C3)cc2oc2c(Cl)cccc12

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 4/20 0.50
▸ LOXL2 Q9Y4K0 1/20 0.39
▸ HTR1A P08908 2/20 0.39
▸ HTR7 P34969 2/20 0.39
▸ HTR6 P50406 2/20 0.39
▸ MAOA P21397 2/20 0.39
▸ PRKDC P78527 1/20 0.39
▸ AR P10275 1/20 0.38
▸ CHRNA7 P36544 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL19642391 1.00 TTR (0.50) TTRLOXL2HTR1AHTR7HTR6
SCHEMBL19642392 1.00 TTR (0.50) TTRLOXL2HTR1AHTR7HTR6
SCHEMBL19662313 0.94 TTR (0.52) TTRLOXL2HTR1AHTR7HTR6
SCHEMBL19641740 0.94 TTR (0.52) TTRLOXL2HTR1AHTR7HTR6
SCHEMBL19642366 0.94 TTR (0.52) TTRLOXL2HTR1AHTR7HTR6
SCHEMBL19642442 0.88 TTR (0.54) TTR
SCHEMBL29547891 0.88 TTR (0.54) TTR
SCHEMBL19642379 0.85 TTR (0.56) TTRHTR1AHTR7HTR6MAOA
SCHEMBL19642435 0.83 NOTUM (0.56) TTR
SCHEMBL19662117 0.83 NOTUM (0.56) TTR

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
Send feedback