SCHEMBL31193430

SCHEMBL31193430

CCCC(Oc1ccc2c(=O)c3cccc(Cl)c3oc2c1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 5/20 0.57
▸ PPARG P37231 3/20 0.49
▸ PPARA Q07869 3/20 0.49
▸ ALDH2 P05091 2/20 0.47
▸ MAOA P21397 4/20 0.46
▸ CSF1R P07333 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ PTGER1 P34995 1/20 0.41
▸ PTGER3 P43115 1/20 0.41
▸ PTGER2 P43116 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PTGDR Q13258 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ AR P10275 1/20 0.40
▸ NPC1 O15118 1/20 0.40

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
SCHEMBL31193431 0.91 TTR (0.59) TTRPPARGPPARAALDH2MAOA
SCHEMBL31193420 0.88 TTR (0.51) TTRMAOACSF1R
SCHEMBL31193444 0.84 TTR (0.61) TTRALDH2MAOAKDM4EMEN1
SCHEMBL31193484 0.82 TTR (0.53) TTRMAOACSF1R
SCHEMBL31193434 0.79 TTR (0.62) TTRALDH2MAOACSF1RKDM4E
SCHEMBL27687212 0.78 TTR (0.62) TTRMAOACSF1RKDM4EALDH1A1
SCHEMBL31193425 0.78 TTR (0.54) TTRMAOACSF1RALDH1A1HPGD
SCHEMBL31193467 0.77 TTR (0.57) TTRMAOACSF1RALDH1A1HPGD
SCHEMBL31193359 0.74 TTR (0.54) TTRMAOACSF1R
SCHEMBL4512899 0.73 TTR (1.00) TTRMAOAKDM4EMEN1ALDH1A1

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-119118983-A Xanthone compound and intermediate thereof, preparation method, pharmaceutical composition and application 上海药坦药物研究开发有限公司 2024-12-13 — — CN claimed
CN-119118983-A Xanthone compound and intermediate thereof, preparation method, pharmaceutical composition and application 上海药坦药物研究开发有限公司 2024-12-13 — — CN disclosed
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