SCHEMBL6423616

SCHEMBL6423616

CC(C)(C)c1cc(Cc2ccc(Nc3c(Cc4cc(C(C)(C)C)c(O)c(C(C)(C)C)c4)cc(Cc4cc(C(C)(C)C)c(O)c(C(C)(C)C)c4)cc3Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)c(Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 2/20 0.44
▸ DHFR P00374 1/20 0.42
▸ ALDH1A1 P00352 6/20 0.40
▸ GAA P10253 4/20 0.40
▸ TSHR P16473 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ GSR P00390 2/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ HIF1A Q16665 3/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ BLM P54132 2/20 0.39
▸ ATM Q13315 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ GMNN O75496 1/20 0.39
▸ GABBR2 O75899 1/20 0.39

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
SCHEMBL6424337 0.93 HSPA5 (0.47) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL13809316 0.91 HSPA5 (0.37) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL6423186 0.87 HSPA5 (0.53) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL15866583 0.86 HSPA5 (0.52) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL13809505 0.82 HSPA5 (0.39) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL13809317 0.82 HSPA5 (0.39) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL6423780 0.82 HSPA5 (0.39) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL13283989 0.82 HSPA5 (0.33) HSPA5DHFRCA1CA2
SCHEMBL13283990 0.81 HSPA5 (0.38) HSPA5DHFRALDH1A1GAATSHR
SCHEMBL15866569 0.80 — —

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
EP-2079677-B1 MACROMOLECULAR AMINE-PHENOLIC ANTIOXIDANT COMPOSITIONS, PROCESS TECHNOLOGY THEREOF, AND USES THEREOF ALBEMARLE CORP (US) 2014-07-09 — — EP disclosed
US-8455414-B2 Macromolecular amine-phenolic antioxidant compositions, process technology thereof, and uses thereof ALBEMARLE CORPORATION (US) 2013-06-04 — — US disclosed
US-20120115764-A1 MACROMOLECULAR AMINE-PHENOLIC ANTIOXIDANT COMPOSITIONS, PROCESS TECHNOLOGY THEREOF, AND USES THEREOF ALBEMARLE CORPORATION (US) 2012-05-10 — — US disclosed
WO-2009073378-A1 INDUSTRIAL OIL FORMULATIONS CONTAINING MACROMOLECULAR ANTIOXIDANTS ALBEMARLE CORPORATION (US) 2009-06-11 — — WO disclosed
WO-2008048989-A2 MACROMOLECULAR AMINE-PHENOLIC ANTIOXIDANT COMPOSITIONS, PROCESS TECHNOLOGY THEREOF, AND USES THEREOF ALBEMARLE CORPORATION (US) 2008-04-24 — — 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 (1 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-20120115764-A1 MACROMOLECULAR AMINE-PHENOLIC ANTIOXIDANT COMPOSITIONS, PROCESS TECHNOLOGY THEREOF, AND USES THEREOF PNMT, COMT, MAOA HSPA5 1734/4885DHFR 3344/4885ALDH1A1 957/4885

“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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