SCHEMBL5267902

SCHEMBL5267902

Oc1ccc([C@H]2Oc3cc(OCc4ccccc4)cc(OCc4ccccc4)c3C(Cc3ccccc3)[C@@]2(Cc2ccccc2)OCc2ccccc2)cc1O

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 1/20 0.33
▸ BCHE P06276 3/20 0.33
▸ ACHE P22303 3/20 0.33
▸ PIN1 Q13526 1/20 0.33
▸ ABCB1 P08183 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MCL1 Q07820 2/20 0.31
▸ MAOB P27338 4/20 0.30
▸ MAOA P21397 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ PTGS2 P35354 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL5264656 0.89 BCHE (0.31) SIRT1BCHEACHEPIN1HIF1A
SCHEMBL5265504 0.88 SIRT1 (0.33) SIRT1BCHEACHEPIN1ABCB1
SCHEMBL5510354 0.84 MAOB (0.35) SIRT1ACHEABCB1MAPTMCL1
SCHEMBL5440151 0.83 SIRT1 (0.33) SIRT1MCL1
SCHEMBL14686069 0.82 MAOB (0.36) SIRT1ABCB1MAPTMCL1MAOB
SCHEMBL5265282 0.79 BCHE (0.31) SIRT1BCHEACHEPIN1HIF1A
SCHEMBL3932086 0.76 MAOB (0.37) SIRT1ACHEABCB1MAPTL3MBTL1
SCHEMBL5267639 0.75 SIRT1 (0.35) SIRT1BCHEACHEPIN1ABCB1
SCHEMBL3670779 0.74 BCHE (0.36) SIRT1BCHEACHEPIN1ABCB1
SCHEMBL3669027 0.74 BCHE (0.36) SIRT1BCHEACHEPIN1ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1317437-B1 SYNTHESIS OF 4-ALPHA-ARYLEPICATECHINS MARS INC (US) 2007-10-03 — — EP claimed
US-20050020512-A1 Synthesis of oligomeric epicatechin and catechin-derived procyanidins MARS, INCORPORATED 2005-01-27 — — US claimed
US-6476241-B1 Synthesis of 4α-arylepicatechins MARS INCORPORATED 2002-11-05 — — US claimed
EP-1317437-B1 SYNTHESIS OF 4-ALPHA-ARYLEPICATECHINS MARS INC (US) 2007-10-03 — — EP disclosed
US-20070197804-A1 Synthesis of 4alpha-arylepicatechins MARS, INCORPORATED 2007-08-23 — — US disclosed
US-7126014-B2 Synthesis of epecatechin-4α, 8-epicatechin and -catechin dimers and derivatives thereof MARS, INC. 2006-10-24 — — US disclosed
US-20050014958-A1 Synthesis of 4alpha-arylepicatechins MARS, INCORPORATED 2005-01-20 — — US disclosed
US-6720432-B2 OXIDIZING HYDROXYL-PROTECTED BENZYLEPITCATECHIN, ADDING NUCLEOPHILIC ARYL-ORGANOMETALLIC REAGENT, AND DEOXYGENATING FORMING COMPOUNDS SUCH AS 3,5,7,3',4'-PENTA-O-BENZYL-4-HYDROXYEPICATECHIN; PROCYANIDINS MARS INCORPORATED 2004-04-13 — — US disclosed
EP-1317437-A2 SYNTHESIS OF 4-ALPHA-ARYLEPICATECHINS Mars Incorporated (US) 2003-06-11 — — EP disclosed
US-20030100775-A1 Synthesis of 4alpha-arylepicatechins MARS INCORPORATED 2003-05-29 — — US disclosed
US-6476241-B1 Synthesis of 4α-arylepicatechins MARS INCORPORATED 2002-11-05 — — US disclosed
WO-2002020506-A2 SYNTHESIS OF 4α-ARYLEPICATECHINS MARS, INCORPORATED (US) 2002-03-14 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030100775-A1 Synthesis of 4alpha-arylepicatechins FABP4, TEAD4, FABP7 SIRT1 1320/4885BCHE 1134/4885ACHE 3773/4885
US-20050014958-A1 Synthesis of 4alpha-arylepicatechins FABP7, FABP4, TEAD4 SIRT1 1749/4885BCHE 724/4885ACHE 3555/4885
US-20070197804-A1 Synthesis of 4alpha-arylepicatechins FABP7, FABP4, TEAD4 SIRT1 1749/4885BCHE 724/4885ACHE 3555/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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