SCHEMBL10688

SCHEMBL10688

CS(=O)(=O)C(CCc1ccc(OCc2ccc3ccccc3n2)cc1)C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.60
AKR1B1 P15121 1/20 0.60
CYSLTR1 Q9Y271 10/20 0.57
CYSLTR2 Q9NS75 8/20 0.57
ALOX5 P09917 3/20 0.55
GPBAR1 Q8TDU6 1/20 0.53
ALOX5AP P20292 1/20 0.49

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
SCHEMBL8834305 0.79 CYSLTR1 (0.69) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5
SCHEMBL11899992 0.78 PARP10 (0.48) FFAR1
SCHEMBL10690 0.78 CYSLTR1 (0.54) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5
SCHEMBL11898956 0.78 ADAM17 (0.50) FFAR1AKR1B1
SCHEMBL8890067 0.77 CYSLTR1 (0.63) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5
SCHEMBL5796 0.77 MAOB (0.46) FFAR1
SCHEMBL8834948 0.77 CYSLTR1 (0.62) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5
SCHEMBL22209124 0.77 FFAR1 (0.80) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5
SCHEMBL8902567 0.77 ALOX5 (0.72) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5
SCHEMBL8834916 0.77 FFAR1 (0.83) FFAR1AKR1B1CYSLTR1CYSLTR2ALOX5

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
US-20140364398-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents PFIZER INC. (US) 2014-12-11 US disclosed
US-8853258-B2 C-linked hydroxamic acid derivatives useful as antibacterial agents PFIZER INC. (US) 2014-10-07 US disclosed
EP-2488489-A2 C-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS Pfizer Inc. (US) 2012-08-22 EP disclosed
US-20120202777-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents BROWN MATTHEW FRANK (US) 2012-08-09 US disclosed
WO-2011045703-A2 C-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS PFIZER INC. (US) 2011-04-21 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-20120202777-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents HAX1, LPXN, AGXT FFAR1 1313/4885AKR1B1 1869/4885CYSLTR1 948/4885
US-20140364398-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents LCT, AGXT, PRXL2A FFAR1 2319/4885AKR1B1 3647/4885CYSLTR1 1740/4885

“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.