SCHEMBL3782725

SCHEMBL3782725

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

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.65
ANPEP P15144 7/20 0.65
PEPD P12955 2/20 0.53
XPNPEP1 Q9NQW7 1/20 0.53
ATM Q13315 1/20 0.41
PIN1 Q13526 1/20 0.40
ALDH1A1 P00352 1/20 0.40
DPP4 P27487 2/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP7 Q9UHL4 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
SCHEMBL3780617 1.00 MMP2 (0.65) MMP2ANPEPPEPDXPNPEP1ATM
SCHEMBL3789843 1.00 MMP2 (0.65) MMP2ANPEPPEPDXPNPEP1ATM
SCHEMBL3785989 1.00 MMP2 (0.65) MMP2ANPEPPEPDXPNPEP1ATM
SCHEMBL14060300 0.86 PEPD (0.53) MMP2ANPEPPEPDXPNPEP1PIN1
SCHEMBL29724334 0.86 PEPD (0.53) MMP2ANPEPPEPDXPNPEP1PIN1
SCHEMBL31059083 0.86 PEPD (0.53) MMP2ANPEPPEPDXPNPEP1PIN1
SCHEMBL542253 0.81 MMP2 (0.67) MMP2ANPEPATMALDH1A1
SCHEMBL993099 0.81 MMP2 (0.67) MMP2ANPEPATMALDH1A1
SCHEMBL542252 0.81 MMP2 (0.67) MMP2ANPEPATMALDH1A1
SCHEMBL3785722 0.80 PEPD (0.52) MMP2ANPEPPEPDXPNPEP1ALDH1A1

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 491/4885PEPD 190/4885

“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.