SCHEMBL12048

SCHEMBL12048

CS(=O)(=O)C(CCc1ccc(OCCc2ccncc2)cc1)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.47
LTA4H P09960 1/20 0.47
PPARA Q07869 3/20 0.42
PPARG P37231 1/20 0.42
FFAR1 O14842 1/20 0.39
PPARD Q03181 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL5796 0.91 MAOB (0.46) FFAR1
SCHEMBL6072 0.85 LMNA (0.52) ACACBPPARAPPARGALDH1A1LMNA
SCHEMBL11899992 0.84 PARP10 (0.48) PPARAPPARGFFAR1PPARDCA12
SCHEMBL11898792 0.80 ADAMTS4 (0.48) ACACBALDH1A1SMN1; SMN2
SCHEMBL12050 0.78 ACACB (0.43) ACACBLTA4HPPARAPPARGFFAR1
SCHEMBL6011 0.78 CA12 (0.46) ACACBCA12CA1CA2CA7
SCHEMBL6157 0.77 PARP10 (0.43) FFAR1CA12CA1CA2CA7
SCHEMBL6211 0.77 MAOB (0.57) PPARAPPARGFFAR1
SCHEMBL11592 0.76 ACACB (0.39) ACACB
SCHEMBL12984880 0.75 CYP3A4 (0.39)

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 ACACB 565/4885LTA4H 115/4885PPARA 2041/4885
US-20140364398-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents LCT, AGXT, PRXL2A ACACB 178/4885LTA4H 352/4885PPARA 2068/4885

“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.