SCHEMBL30677928

SCHEMBL30677928

O=c1cc(-c2ccc(F)cc2)c2c(O)cc(O)cc2o1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP1LC3B Q9GZQ8 1/20 0.74
▸ ABCB1 P08183 5/20 0.60
▸ ALDH1A1 P00352 7/20 0.55
▸ TSHR P16473 4/20 0.55
▸ ALOX15 P16050 4/20 0.55
▸ MAPK1 P28482 3/20 0.55
▸ HPGD P15428 6/20 0.53
▸ CYP3A4 P08684 4/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ CA9 Q16790 3/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ CASP7 P55210 1/20 0.53
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ TDP1 Q9NUW8 4/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ RAB9A P51151 2/20 0.49

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
SCHEMBL29115369 1.00 MAP1LC3B (0.74) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL8580581 0.89 MAP1LC3B (0.80) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL30231429 0.86 MAP1LC3B (0.55) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL30228362 0.86 ALDH1A1 (0.75) MAP1LC3BALDH1A1TSHRALOX15MAPK1
SCHEMBL3787335 0.85 MAP1LC3B (1.00) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL29115413 0.84 MAP1LC3B (0.76) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL29115331 0.82 MAP1LC3B (0.68) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL30677926 0.82 MAP1LC3B (0.68) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL3782904 0.81 LMNA (0.67) MAP1LC3BABCB1ALDH1A1TSHRALOX15
SCHEMBL21648244 0.78 CA12 (0.74) ALDH1A1HPGDHSD17B10CA9CASP1

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
CN-117143093-A Protein degradation agent and preparation method and application thereof 中国科学院上海药物研究所 2023-12-01 — — CN disclosed
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