SCHEMBL30619656

SCHEMBL30619656

COC(=O)Cc1ccc(O)cc1O

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.57
ALDH1A1 P00352 2/20 0.54
GAA P10253 2/20 0.54
KDM4E B2RXH2 1/20 0.54
GLA P06280 1/20 0.54
HSP90AB1 P08238 1/20 0.52
TYR P14679 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
PDK2 Q15119 1/20 0.50
PDK4 Q16654 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
GFER P55789 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL8764395 1.00 EGFR (0.57) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL8138023 0.87 EGFR (0.59) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL6035480 0.86 POLB (0.64) EGFRALDH1A1KDM4EHSP90AB1POLB
SCHEMBL29645403 0.86 ALDH1A1 (0.51) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL1922818 0.86 ALDH1A1 (0.51) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL30336005 0.86 POLB (0.64) EGFRALDH1A1KDM4EHSP90AB1POLB
SCHEMBL3545527 0.85 EGFR (0.75) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL30605142 0.85 EGFR (0.75) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL3922071 0.84 EGFR (0.52) EGFRALDH1A1GAAKDM4EGLA
SCHEMBL14186623 0.84 GAA (0.46) EGFRALDH1A1GAAKDM4EGLA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118416044-A Application of rambutan phenolic acid compound in preparation of medicine for preventing and treating neurodegenerative diseases 集美大学 2024-08-02 CN claimed
CN-118416044-A Application of rambutan phenolic acid compound in preparation of medicine for preventing and treating neurodegenerative diseases 集美大学 2024-08-02 CN disclosed
CN-118416044-A Application of rambutan phenolic acid compound in preparation of medicine for preventing and treating neurodegenerative diseases 集美大学 2024-08-02 CN disclosed
CN-117797216-A Preparation method of tomato pulp, tomato pulp and application of tomato pulp 河北科技师范学院 2024-04-02 CN disclosed
CN-114044844-B Chelate resin and preparation method and application thereof 上海应用技术大学 2023-09-26 CN disclosed