SCHEMBL3545831

SCHEMBL3545831

COC(=O)C1CCN1C(=O)c1cc(CCC(F)(F)F)c(OC)c(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.47
PDK2 Q15119 2/20 0.44
PKM P14618 1/20 0.42
GAA P10253 1/20 0.40
MMP2 P08253 1/20 0.39
ANPEP P15144 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
PEPD P12955 1/20 0.38

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
SCHEMBL3545832 1.00 FKBP1A (0.47) FKBP1APDK2PKMGAAMMP2
SCHEMBL3544072 0.90 MMP2 (0.41) FKBP1APKMGAAMMP2ANPEP
SCHEMBL3544068 0.90 MMP2 (0.41) FKBP1APKMGAAMMP2ANPEP
SCHEMBL3544267 0.87 FKBP1A (0.51) FKBP1AGAAMMP2ANPEPALDH1A1
SCHEMBL3544265 0.87 FKBP1A (0.51) FKBP1AGAAMMP2ANPEPALDH1A1
SCHEMBL3542454 0.87 FKBP1A (0.48) FKBP1APDK2GAAMMP2ANPEP
SCHEMBL3542453 0.87 FKBP1A (0.48) FKBP1APDK2GAAMMP2ANPEP
SCHEMBL3540519 0.85 FKBP1A (0.49) FKBP1APDK2GAAMMP2ANPEP
SCHEMBL3540713 0.85 FKBP1A (0.49) FKBP1AGAAMMP2ANPEPALDH1A1
SCHEMBL3540711 0.85 FKBP1A (0.49) FKBP1AGAAMMP2ANPEPALDH1A1

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 2 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

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 FKBP1A 3069/4885PDK2 2445/4885PKM 4091/4885

“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.