SCHEMBL3547391

SCHEMBL3547391

COC(=O)C1CCN1C(=O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.56
HSD11B1 P28845 1/20 0.53
MGLL Q99685 3/20 0.52
TAS1R3 Q7RTX0 1/20 0.49
TAS1R1 Q7RTX1 1/20 0.49
TAS1R2 Q8TE23 1/20 0.49
MAPK7 Q13164 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4D Q08499 1/20 0.47
CACNA1B Q00975 1/20 0.46
P2RX7 Q99572 1/20 0.45
LOX P28300 1/20 0.45
NOTUM Q6P988 1/20 0.44
CFD P00746 1/20 0.44
PTGDR2 Q9Y5Y4 2/20 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
SCHEMBL3547392 1.00 PDK2 (0.56) PDK2HSD11B1MGLLTAS1R3TAS1R1
SCHEMBL3545565 0.86 HSD11B1 (0.53) PDK2HSD11B1MGLLTAS1R3TAS1R1
SCHEMBL3545564 0.86 HSD11B1 (0.53) PDK2HSD11B1MGLLTAS1R3TAS1R1
Hydroxyamine SCHEMBL5238636 0.85 HSD11B1 (0.54) HSD11B1MGLLTAS1R3TAS1R1TAS1R2
Hydroxyamine SCHEMBL5238639 0.85 HSD11B1 (0.54) HSD11B1MGLLTAS1R3TAS1R1TAS1R2
SCHEMBL3546371 0.81 PDK2 (0.55) PDK2PDE4BPDE4D
SCHEMBL3551107 0.81 PDK2 (0.55) PDK2PDE4BPDE4D
SCHEMBL3551111 0.81 PDK2 (0.55) PDK2PDE4BPDE4D
SCHEMBL3546372 0.81 PDK2 (0.55) PDK2PDE4BPDE4D
SCHEMBL3546501 0.80 PDK2 (0.52) PDK2LOX

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-7691843-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2010-04-06 US disclosed
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity VICURON HOLDINGS LLC 2008-03-06 US disclosed
EP-1539744-A4 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARM INC (US) 2007-06-06 EP disclosed
EP-1539744-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2005-06-15 EP disclosed
WO-2004007444-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2004-01-22 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 (1 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-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity AMDHD2, OGA, ENGASE PDK2 2445/4885HSD11B1 2141/4885MGLL 649/4885

“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.