SCHEMBL3789111

SCHEMBL3789111

COC(=O)[C@H]1C[C@@H](O)CN1C(C)=O

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.72
ANPEP P15144 8/20 0.72
ATM Q13315 1/20 0.65
ALDH1A1 P00352 1/20 0.59
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PEPD P12955 1/20 0.40
VHL P40337 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
SCHEMBL3783083 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3788774 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3783080 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3788772 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3784082 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL10793356 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL996114 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL8401942 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3272061 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL8401692 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100174096-A1 Methods for Production of Optically Active Fluoropyrrolidine Derivatives IM&T RESEARCH, INC. (US) 2010-07-08 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-20100174096-A1 Methods for Production of Optically Active Fluoropyrrolidine Derivatives QDPR, FDPS, DPYD MMP2 2155/4885ANPEP 491/4885ATM 4690/4885

“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.