SCHEMBL5069879

SCHEMBL5069879

COc1ccc(C=O)c(O)c1Br

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 14/20 0.58
TLR2 O60603 1/20 0.58
TLR1 Q15399 1/20 0.58
TLR6 Q9Y2C9 1/20 0.58
PRKDC P78527 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TRIM24 O15164 1/20 0.44
TYR P14679 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
AOX1 Q06278 1/20 0.44

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
SCHEMBL149415 0.85 ERN1 (0.59) ERN1TLR2TLR1TLR6PRKDC
SCHEMBL1637980 0.85 ERN1 (0.59) ERN1TLR2TLR1TLR6PRKDC
SCHEMBL1527154 0.82 ERN1 (0.69) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL31195180 0.79 PRKDC (0.48) ERN1TLR2TLR1TLR6PRKDC
SCHEMBL1534505 0.79 PRKDC (0.48) ERN1TLR2TLR1TLR6PRKDC
SCHEMBL3466295 0.79 PRKDC (0.48) ERN1TLR2TLR1TLR6PRKDC
SCHEMBL29683824 0.79 ERN1 (0.59) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL3658867 0.79 ERN1 (0.59) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL5645697 0.79 ERN1 (0.59) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL10658941 0.78 ERN1 (0.58) ERN1TLR2TLR1TLR6ALDH1A1

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 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114933519-B Method for improving yield of 3-bromo-2-hydroxy-4-methoxybenzaldehyde by adopting titanium tetrachloride 大理大学 2024-08-06 CN claimed
CN-117024389-A Total synthesis method of coumarin compound trans-dehydroosthol 大理大学 2023-11-10 CN claimed
CN-115232094-B Synthesis method of coumarin compound Murraol 大理大学 2023-05-12 CN claimed
CN-115232094-A Synthetic method of coumarin compound Murroal 大理大学 2022-10-25 CN claimed
CN-114933519-A Method for increasing yield of 3-bromo-2-hydroxy-4-methoxybenzaldehyde by adopting titanium tetrachloride 大理大学 2022-08-23 CN claimed
EP-4741389-A1 KAT6 INHIBITOR Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2026-05-13 EP disclosed
WO-2025007873-A1 KAT6 INHIBITOR 上海齐鲁制药研究中心有限公司 2025-01-09 WO disclosed
US-20240409609-A1 REVERSIBLE LYSINE COVALENT MODIFIERS OF EGFR AND USES THEREOF TERREMOTO BIOSCIENCES, INC. 2024-12-12 US disclosed
CN-114933519-B Method for improving yield of 3-bromo-2-hydroxy-4-methoxybenzaldehyde by adopting titanium tetrachloride 大理大学 2024-08-06 CN disclosed
CN-114933519-B Method for improving yield of 3-bromo-2-hydroxy-4-methoxybenzaldehyde by adopting titanium tetrachloride 大理大学 2024-08-06 CN disclosed
CN-114933519-B Method for improving yield of 3-bromo-2-hydroxy-4-methoxybenzaldehyde by adopting titanium tetrachloride 大理大学 2024-08-06 CN disclosed
CN-117024389-A Total synthesis method of coumarin compound trans-dehydroosthol 大理大学 2023-11-10 CN disclosed
US-20040181075-A1 Process of making chalcone derivatives GENERAL ELECTRIC COMPANY 2004-09-16 US disclosed
EP-1438281-A2 FUNCTIONALIZED STILBENE DERIVATIVES AS IMPROVED VASCULAR TARGETING AGENTS Oxigene, Inc. (US) 2004-07-21 EP disclosed
WO-2004056727-A2 PROCESS OF MAKING CHALCONE DERIVATIVES ATHEROGENICS, INC. (US) 2004-07-08 WO disclosed
US-20040048858-A1 Chalcone derivatives and their use to treat diseases CRABTREE ACQUISITION CO, LLC 2004-03-11 US disclosed
US-20030149003-A1 Functionalized stilbene derivatives as improved vascular targeting agents MATEON THERAPEUTICS, INC. 2003-08-07 US disclosed
WO-2003053368-A2 CHALCONE DERIVATIVES AND THEIR USE TO TREAT DISEASES ATHEROGENICS, INC. (US) 2003-07-03 WO disclosed
WO-2003035008-A2 FUNCTIONALIZED STILBENE DERIVATIVES AS IMPROVED VASCULAR TARGETING AGENTS OXIGENE, INC. (US) 2003-05-01 WO disclosed
US-5302700-A Site-specific; couple with macromolecules for diagnostic, therapeutic or investigative purposes DUKE UNIVERSITY (US) 1994-04-12 US 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 (4 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-20030149003-A1 Functionalized stilbene derivatives as improved vascular targeting agents FLT1, FLT4, KDR ERN1 3673/4885TLR2 1863/4885TLR1 204/4885
US-20240409609-A1 REVERSIBLE LYSINE COVALENT MODIFIERS OF EGFR AND USES THEREOF EGFR, ERBB2, ERBB3 ERN1 1399/4885TLR2 4029/4885TLR1 4588/4885
US-20040181075-A1 Process of making chalcone derivatives CYP2B6, LSS, CYP2E1 ERN1 2696/4885TLR2 3616/4885TLR1 4256/4885
US-20040048858-A1 Chalcone derivatives and their use to treat diseases CYP46A1, CYP11B1, HSD17B7 ERN1 1076/4885TLR2 2718/4885TLR1 1216/4885

“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.