SCHEMBL2166529

SCHEMBL2166529

COc1ccc(C(=O)CBr)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.54
TAS1R3 Q7RTX0 7/20 0.51
TAS1R1 Q7RTX1 7/20 0.51
PDE4D Q08499 1/20 0.50
MAPT P10636 3/20 0.48
POLB P06746 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
KCNH2 Q12809 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
ALOX15 P16050 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL29620782 1.00 GSK3B (0.54) GSK3BTAS1R3TAS1R1PDE4DMAPT
SCHEMBL23112630 0.87 GSK3B (0.54) GSK3BPDE4DMAPTMEN1KMT2A
SCHEMBL6136939 0.85 TAS1R3 (0.53) GSK3BTAS1R3TAS1R1PDE4DMAPT
SCHEMBL12780432 0.85 MEN1 (0.59) TAS1R3TAS1R1PDE4DMAPTPOLB
SCHEMBL6329414 0.85 TAS1R3 (0.53) TAS1R3TAS1R1PDE4DMAPTPOLB
SCHEMBL426444 0.84 TSHR (0.63) GSK3BPDE4DMAPTPOLBMEN1
SCHEMBL29620831 0.84 TSHR (0.63) GSK3BPDE4DMAPTPOLBMEN1
SCHEMBL22570710 0.83 TAS1R3 (0.51) TAS1R3TAS1R1PDE4DMAPTPOLB
SCHEMBL9155650 0.83 PDE4D (0.54) TAS1R3TAS1R1PDE4DMAPTPOLB
SCHEMBL7393792 0.83 POLB (0.49) TAS1R3TAS1R1PDE4DMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4232448-B1 AGONISTS OF FREE FATTY ACID RECEPTOR 1 AND THEIR USE IN DISEASES ASSOCIATED WITH SAID RECEPTOR Halo Therapeutics Ltd (GB) 2025-05-07 EP disclosed
EP-3956323-B1 OXAZOLE AND OXADIAZOLE DERIVATIVES USEFUL AS AGONISTS OF FREE FATTY ACID RECEPTOR 1 Halo Therapeutics Ltd (GB) 2025-03-05 EP disclosed
US-20240158382-A1 Agonists Of Free Fatty Acid Receptor 1 And Their Use In Diseases Associated With Said Receptor Halo Therapeutics Ltd (GB) 2024-05-16 US disclosed
EP-4232448-A1 AGONISTS OF FREE FATTY ACID RECEPTOR 1 AND THEIR USE IN DISEASES ASSOCIATED WITH SAID RECEPTOR Halo Therapeutics Ltd (GB) 2023-08-30 EP disclosed
US-20220274968-A1 Oxazole And Oxadiazole Derivatives Useful As Agonists Of Free Fatty Acid Receptor 1 GBIOTECH S.À.R.L. (CH) 2022-09-01 US disclosed
US-11345694-B2 Antibacterial compounds DISCUVA LTD. (GB) 2022-05-31 US disclosed
US-11345694-B2 Antibacterial compounds DISCUVA LTD. (GB) 2022-05-31 US disclosed
WO-2022083853-A1 AGONISTS OF FREE FATTY ACID RECEPTOR 1 AND THEIR USE IN DISEASES ASSOCIATED WITH SAID RECEPTOR GBIOTECH S.À.R.L. (CH) 2022-04-28 WO disclosed
EP-3956323-A1 OXAZOLE AND OXADIAZOLE DERIVATIVES USEFUL AS AGONISTS OF FREE FATTY ACID RECEPTOR 1 Gbiotech S.À.R.L. (CH) 2022-02-23 EP disclosed
US-20210163460-A1 ANTIBACTERIAL COMPOUNDS DISCUVA LTD. (GB) 2021-06-03 US disclosed
US-20110183976-A1 5- AND 6-MEMBERED HETEROCYCLIC COMPOUNDS FMR LLC 2011-07-28 US disclosed
WO-2009158473-A1 5- AND 6-MEMBERED HETEROCYCLIC COMPOUNDS ENVIVO PHARMACEUTICALS, INC. (US) 2009-12-30 WO disclosed
EP-0835872-B1 Benzo [b] thiophene compounds, intermediates, formulations, and methods LILLY CO ELI (US) 2006-03-01 EP disclosed
US-5948796-A OSTEOPOROSIS, CANCER, CARDIOVASCULAR DISORDERS ELI LILLY AND COMPANY (US) 1999-09-07 US disclosed
EP-0743938-B1 SUBSTITUTED SPIRO COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 1999-04-21 EP disclosed
EP-0639049-B1 HALOGENATED 4'-METHOXYACETOPHENONES AS MICROBICIDES AND PRESERVATIVES BUCKMAN LABOR INC (US) 1998-07-29 EP disclosed
EP-0835872-A1 Benzo [b] thiophene compounds, intermediates, formulations, and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed
US-5466717-A INHIBITING THE GROWTH OF MICROORGANISMS IN AN AQUEOUS SYSTEM BUCKMAN LABORATORIES INT'L, INC. (US) 1995-11-14 US disclosed
EP-0639049-A1 HALOGENATED 4'-METHOXYACETOPHENONES AS MICROBICIDES AND PRESERVATIVES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1995-02-22 EP disclosed
WO-1993022918-A1 HALOGENATED 4'-METHOXYACETOPHENONES AS MICROBICIDES AND PRESERVATIVES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1993-11-25 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 (5 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-20240158382-A1 Agonists Of Free Fatty Acid Receptor 1 And Their Use In Diseases Associated With Said Receptor FFAR1, FFAR2, FFAR3 GSK3B 4031/4885TAS1R3 768/4885TAS1R1 685/4885
US-11345694-B2 Antibacterial compounds CFTR, MRPL21, NQO1 GSK3B 1521/4885TAS1R3 3401/4885TAS1R1 3198/4885
US-20110183976-A1 5- AND 6-MEMBERED HETEROCYCLIC COMPOUNDS ACHE, PDE7A, PDE5A GSK3B 934/4885TAS1R3 4361/4885TAS1R1 4194/4885
US-20210163460-A1 ANTIBACTERIAL COMPOUNDS CFTR, MRPL21, NQO1 GSK3B 1521/4885TAS1R3 3401/4885TAS1R1 3198/4885
US-20220274968-A1 Oxazole And Oxadiazole Derivatives Useful As Agonists Of Free Fatty Acid Receptor 1 FFAR2, FFAR1, FFAR3 GSK3B 1838/4885TAS1R3 275/4885TAS1R1 366/4885

“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.