SCHEMBL6011

SCHEMBL6011

C#CCOc1ccc(CCC(C(N)=O)S(C)(=O)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA1 P00915 1/20 0.46
CA4 P22748 1/20 0.46
CA7 P43166 1/20 0.46
MTNR1A P48039 1/20 0.38
GSTP1 P09211 1/20 0.37
CYP19A1 P11511 1/20 0.37
ACACB O00763 3/20 0.36
MMP1 P03956 2/20 0.35
MMP9 P14780 2/20 0.35
MMP13 P45452 2/20 0.35
ADAM17 P78536 2/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
PARP1 P09874 1/20 0.35

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
SCHEMBL6072 0.82 LMNA (0.52) CA12CA2CA9CA1CA7
SCHEMBL11899992 0.81 PARP10 (0.48) CA12CA2CA9CA1CA7
SCHEMBL6157 0.79 PARP10 (0.43) CA12CA2CA9CA1CA4
SCHEMBL12048 0.78 ACACB (0.47) CA12CA2CA9CA1CA7
SCHEMBL5796 0.78 MAOB (0.46) MMP13ADAM17
SCHEMBL6211 0.76 MAOB (0.57) MMP9MMP13ADAM17
SCHEMBL5810 0.76 MMP1 (0.48) CYP19A1MMP1MMP9ADAM17
SCHEMBL5790 0.75 ACACB (0.48) ACACB
SCHEMBL11898792 0.75 ADAMTS4 (0.48) CYP19A1ACACBMMP13
SCHEMBL10157 0.73 MMP12 (0.50) MMP9MMP13

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 CA12 2430/4885CA2 1239/4885CA9 412/4885
US-20140364398-A1 C-Linked Hydroxamic Acid Derivatives Useful As Antibacterial Agents LCT, AGXT, PRXL2A CA12 1937/4885CA2 1183/4885CA9 446/4885

“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.