SCHEMBL348782

SCHEMBL348782

O=C(Cl)CCCCCCCCBr

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
ALDH1A1 P00352 2/20 0.56
TP53 P04637 1/20 0.48
LMNA P02545 3/20 0.36
NFKB1 P19838 1/20 0.36
PMP22 Q01453 1/20 0.36
FAAH O00519 1/20 0.34
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CES2 O00748 3/20 0.31
CES1 P23141 3/20 0.31
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31

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
SCHEMBL306578 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL347793 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL347023 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL11255873 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL13859605 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL34211 1.00
SCHEMBL347787 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL305763 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL349064 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1
SCHEMBL28244416 1.00 TSHR (0.56) TSHRALDH1A1TP53LMNANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113876595-A Birch alcohol-based quaternary ammonium salt antibacterial organic monomer, application of composite resin of birch alcohol-based quaternary ammonium salt antibacterial organic monomer and preparation method of composite resin of birch alcohol-based quaternary ammonium salt antibacterial organic monomer 东华大学 2022-01-04 CN claimed
US-12583816-B2 Lipids for lipid nanoparticle delivery of active agents Acuitas Therapeutics, Inc. (CA) 2026-03-24 US disclosed
CN-112707900-B Protein degrading agents and their use in the treatment of disease 上海科技大学 2022-06-10 CN disclosed
CN-113876595-A Birch alcohol-based quaternary ammonium salt antibacterial organic monomer, application of composite resin of birch alcohol-based quaternary ammonium salt antibacterial organic monomer and preparation method of composite resin of birch alcohol-based quaternary ammonium salt antibacterial organic monomer 东华大学 2022-01-04 CN disclosed
US-20210395188-A1 LIPIDS FOR LIPID NANOPARTICLE DELIVERY OF ACTIVE AGENTS Acuitas Therapeutics, Inc. (CA) 2021-12-23 US disclosed
WO-2021078301-A1 PROTEIN DEGRADING AGENT AND USE THEREOF IN TREATMENT OF DISEASES 上海科技大学 2021-04-29 WO disclosed
CN-112707900-A Protein degradation agent and application thereof in disease treatment 上海科技大学 2021-04-27 CN disclosed
WO-2020081938-A1 LIPIDS FOR LIPID NANOPARTICLE DELIVERY OF ACTIVE AGENTS Acuitas Therapeutics, Inc. (CA) 2020-04-23 WO disclosed
EP-1719768-B1 NOVEL BENZOTHIAZEPINE AND BENZOTHIEPINE COMPOUNDS ASAHI KASEI PHARMA CORP (JP) 2012-04-25 EP disclosed
US-20120015925-A1 NOVEL BENZOTHIAZEPINE AND BENZOTHIEPINE COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2012-01-19 US disclosed
US-20050131002-A1 Novel amide compounds and medications containing the same KOWA COMPANY LTD. (JP) 2005-06-16 US disclosed
EP-1535913-A1 NOVEL QUATERNARY AMMONIUM COMPOUNDS Asahi Kasei Pharma Corporation (JP) 2005-06-01 EP disclosed
US-6849647-B1 Amide compounds and medications containing the same technical field KOWA COMPANY, LTD. (JP) 2005-02-01 US disclosed
US-20050009805-A1 Novel quaternary ammonium compounds ASAHI KASEI PHARMA CORPORATION (JP) 2005-01-13 US disclosed
EP-1028955-B1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 2003-07-16 EP disclosed
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 US disclosed
US-6417192-B1 DRUGS WITH PYRIMIDONE COMPOUNDS INHIBITORS OF THE ENZYME LDL PLA.SUB.2 AND THEREFORE OF USE IN TREATING ATHEROSCLEROSIS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-09 US disclosed
EP-1028955-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SmithKline Beecham p.l.c. (GB) 2000-08-23 EP disclosed
EP-0979823-A1 NOVEL AMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME Kowa Company Ltd. (JP) 2000-02-16 EP disclosed
WO-1999024420-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 1999-05-20 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 (6 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-20210395188-A1 LIPIDS FOR LIPID NANOPARTICLE DELIVERY OF ACTIVE AGENTS PHOSPHO1, NPC1, LRAT TSHR 2461/4885ALDH1A1 1158/4885TP53 1704/4885
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them PLA2G7, PLA2G1B, PLA2G4C TSHR 4310/4885ALDH1A1 960/4885TP53 4558/4885
US-20050009805-A1 Novel quaternary ammonium compounds SLC10A1, GOT1, ACAT2 TSHR 2727/4885ALDH1A1 1743/4885TP53 3898/4885
US-12583816-B2 Lipids for lipid nanoparticle delivery of active agents NPC1, LDLR, SGMS1 TSHR 2589/4885ALDH1A1 1473/4885TP53 3226/4885
US-20050131002-A1 Novel amide compounds and medications containing the same ACAT2, SULT2A1, ACAT1 TSHR 2127/4885ALDH1A1 1410/4885TP53 3428/4885
US-20120015925-A1 NOVEL BENZOTHIAZEPINE AND BENZOTHIEPINE COMPOUNDS SLC10A1, SREBF1, SPTLC1 TSHR 3208/4885ALDH1A1 1261/4885TP53 4483/4885

“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.