SCHEMBL18427307

SCHEMBL18427307

O[C@H]1c2c(OCc3ccccc3)cc(OCc3ccccc3)cc2O[C@H](c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)[C@H]1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 1/20 0.38
▸ HIF1A Q16665 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA5A P35218 1/20 0.35
▸ APP P05067 1/20 0.35
▸ BCHE P06276 2/20 0.35
▸ ACHE P22303 2/20 0.35
▸ MAOB P27338 3/20 0.35
▸ MAOA P21397 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PDE4A P27815 1/20 0.34
▸ PDE4B Q07343 1/20 0.34
▸ PDE4C Q08493 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ EGFR P00533 2/20 0.34

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
SCHEMBL5265501 1.00 PIN1 (0.38) PIN1HIF1AL3MBTL1ALDH1A1CA2
SCHEMBL5268318 1.00 PIN1 (0.38) PIN1HIF1AL3MBTL1ALDH1A1CA2
SCHEMBL5523109 0.92 SIRT1 (0.41) PIN1HIF1AL3MBTL1CA2CA5A
SCHEMBL5620552 0.92 SIRT1 (0.41) PIN1HIF1AL3MBTL1CA2CA5A
SCHEMBL3668993 0.89 PIN1 (0.39) PIN1HIF1AL3MBTL1ALDH1A1CA2
SCHEMBL3669336 0.89 PIN1 (0.39) PIN1HIF1AL3MBTL1ALDH1A1CA2
SCHEMBL17358232 0.88 APP (0.37) HIF1AL3MBTL1APPMAOBTP53
SCHEMBL3932082 0.87 STING1 (0.41) HIF1AALDH1A1APPMAOBMEN1
SCHEMBL5265280 0.85 PIN1 (0.36) PIN1HIF1AALDH1A1APPBCHE
SCHEMBL5265555 0.85 PIN1 (0.36) PIN1HIF1AALDH1A1APPBCHE

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
EP-2948437-B1 APPROACH FOR SYNTHESIS OF CATECHINS EPIRIUM BIO INC (US) 2021-11-03 — — EP disclosed
US-9556140-B2 Approach for synthesis of catechins SPHAERA PHARMA PVT. LTD. (IN) 2017-01-31 — — US disclosed
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