SCHEMBL330066

SCHEMBL330066

O=C(O)CCc1ccc(CP(=O)(OF)OF)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.52
KEAP1 Q14145 1/20 0.50
FFAR4 Q5NUL3 4/20 0.45
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
SRD5A2 P31213 1/20 0.43

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
SCHEMBL3736933 0.82 CA2 (0.48) FFAR1LMNACA2SRD5A2
SCHEMBL2893895 0.80 L3MBTL1 (0.50) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL4955209 0.79 FFAR1 (0.47) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL69746 0.77 FFAR1 (0.81) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL6719582 0.76 SLC7A5 (0.56) LMNA
SCHEMBL18526934 0.75 HPGD (0.48)
Hydrochloric Acid SCHEMBL25264643 0.74 FFAR1 (0.77) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL5504259 0.72 PGK1 (0.32)
SCHEMBL6951625 0.72 TRPA1 (0.36)
SCHEMBL13800077 0.71 FFAR1 (0.65) FFAR1KEAP1FFAR4LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11821109-B2 Compartmentalised combinatorial chemistry by microfluidic control PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-11-21 US disclosed
US-20230366125-A1 COMPARTMENTALISED COMBINATORIAL CHEMISTRY BY MICROFLUIDIC CONTROL UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2023-11-16 US disclosed
US-20200333334-A1 COMPARTMENTALISED SCREENING BY MICROFLUIDIC CONTROL MEDICAL RESEARCH COUNCIL (GB) 2020-10-22 US disclosed
US-10705078-B2 Compartmentalised screening by microfluidic control UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2020-07-07 US disclosed
US-20190317085-A1 COMPARTMENTALISED SCREENING BY MICROFLUIDIC CONTROL PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2019-10-17 US disclosed
EP-3527978-A2 COMPARTMENTALISED SCREENING BY MICROFLUIDIC CONTROL United Kingdom Research and Innovation (GB) 2019-08-21 EP disclosed
EP-3524344-A1 METHOD OF SYNTHESIS AND TESTING OF COMBINATORIAL LIBRARIES USING MICROCAPSULES United Kingdom Research and Innovation (GB) 2019-08-14 EP disclosed
US-10371699-B2 Compartmentalised screening by microfluidic control PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-08-06 US disclosed
EP-3492917-A1 SELECTION BY COMPARTMENTALISED SCREENING United Kingdom Research and Innovation (GB) 2019-06-05 EP disclosed
EP-3492916-A1 SELECTION OF NUCLEIC ACIDS BY COMPARTMENTALISED SCREENING United Kingdom Research and Innovation (GB) 2019-06-05 EP disclosed
US-20060154298-A1 Method of synthesis and testing of combinatorial libraries using microcapsules MEDICAL RESEARCH COUNCIL 2006-07-13 US disclosed
US-20060153924-A1 Selection by compartmentalised screening MEDICAL RESEARCH COUNCIL 2006-07-13 US disclosed
WO-2006040554-A1 COMPARTMENTALISED COMBINATORIAL CHEMISTRY BY MICROFLUIDIC CONTROL MEDICAL RESEARCH COUNCIL (GB) 2006-04-20 WO disclosed
WO-2006040551-A2 COMPARTMENTALISED SCREENING BY MICROFLUIDIC CONTROL MEDICAL RESEARCH COUNCIL (GB) 2006-04-20 WO disclosed
US-20060078893-A1 Compartmentalised combinatorial chemistry by microfluidic control MEDICAL RESEARCH COUNCIL 2006-04-13 US disclosed
EP-1608976-A1 SELECTION BY COMPARTMENTALISED SCREENING Medical Research Council (GB) 2005-12-28 EP disclosed
EP-1606049-A1 METHOD OF SYNTHESIS AND TESTING OF COMBINATORIAL LIBRARIES USING MICROCAPSULES Medical Research Council (GB) 2005-12-21 EP disclosed
US-20050221339-A1 Compartmentalised screening by microfluidic control MEDICAL RESEARCH COUNCIL HARVARD UNIVERSITY 2005-10-06 US disclosed
WO-2004088314-A1 SELECTION BY COMPARTMENTALISED SCREENING MEDICAL RESEARCH COUNCIL (GB) 2004-10-14 WO disclosed
WO-2004087308-A1 METHOD OF SYNTHESIS AND TESTING OF COMBINATORIAL LIBRARIES USING MICROCAPSULES MEDICAL RESEARCH COUNCIL (GB) 2004-10-14 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 (2 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-11821109-B2 Compartmentalised combinatorial chemistry by microfluidic control STUB1, ACACB, MCCC2 FFAR1 4185/4885KEAP1 1743/4885FFAR4 4064/4885
US-20230366125-A1 COMPARTMENTALISED COMBINATORIAL CHEMISTRY BY MICROFLUIDIC CONTROL STUB1, ACACB, MCCC2 FFAR1 4185/4885KEAP1 1743/4885FFAR4 4064/4885

“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.