SCHEMBL10027149

SCHEMBL10027149

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

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.67
ANPEP P15144 8/20 0.67
PEPD P12955 2/20 0.52
ATM Q13315 1/20 0.46
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.38
XPNPEP1 Q9NQW7 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL10027150 1.00 MMP2 (0.67) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL5494889 1.00 MMP2 (0.67) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL3788772 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL3783083 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL3788774 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL10793356 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL3784082 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL3783080 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL3789111 0.85 MMP2 (0.72) MMP2ANPEPPEPDATMALDH1A1
SCHEMBL12395381 0.84 PEPD (0.55) MMP2ANPEPPEPDALDH1A1TSHR

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-20140309265-A1 MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS ENSEMBLE THERAPEUTICS (US) 2014-10-16 US disclosed
US-20120022040-A1 ANTIMICROBIALS AMPLYX PHARMACEUTICALS, INC. 2012-01-26 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 (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-20140309265-A1 MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS API5, BIRC5, BAD MMP2 2035/4885ANPEP 1414/4885PEPD 1117/4885
US-20120022040-A1 ANTIMICROBIALS PAM, MPO, OXA1L MMP2 828/4885ANPEP 75/4885PEPD 8/4885

“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.