SCHEMBL19084116

SCHEMBL19084116

CCC(=O)N1CSC[C@H]1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.55
PREP P48147 10/20 0.37
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
DPP4 P27487 2/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP7 Q9UHL4 1/20 0.33

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
SCHEMBL6051964 1.00 ACE (0.55) ACEPREPMEN1TSHRHTT
SCHEMBL11220344 0.93 ACE (0.54) ACEPREPMEN1TSHRHTT
SCHEMBL6052009 0.86 ACE (0.53) ACEPREPDPP4DPP8DPP7
SCHEMBL11381314 0.85 ACE (0.54) ACEPREPDPP4DPP8DPP7
SCHEMBL10940644 0.83 ACE (0.53) ACEPREPDPP4DPP8DPP7
SCHEMBL20718946 0.82 ACE (0.53) ACEPREPKMT2ADPP4DPP8
SCHEMBL11392768 0.81 ACE (0.59) ACEPREP
SCHEMBL31590738 0.81 ACE (0.51) ACEPREPKMT2ADPP4DPP8
SCHEMBL9362241 0.81 ACE (0.51) ACEPREP
SCHEMBL7352024 0.81 ACE (0.51) ACEPREPKMT2ADPP4DPP8

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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 ACE 1083/4885PREP 1510/4885MEN1 1465/4885

“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.