SCHEMBL7150279

SCHEMBL7150279

CCOC(=O)c1ccc(NC(=O)CNCC(=O)C2CC(S)CN2S(=O)(=O)CCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
GAA P10253 5/20 0.46
LMNA P02545 1/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 5/20 0.43
ALOX12 P18054 1/20 0.43
MAPK1 P28482 3/20 0.42
ABL1 P00519 1/20 0.42
RIN1 Q13671 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 2/20 0.42
NAMPT P43490 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
ADRB2 P07550 1/20 0.41

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
SCHEMBL7152592 0.95 MAPT (0.44) MAPTGAALMNAKMT2AMEN1
SCHEMBL7148170 0.92 MAPT (0.53) MAPTGAALMNAKMT2AMEN1
SCHEMBL7136104 0.86 MAPT (0.46) MAPTGAALMNAKMT2AMEN1
SCHEMBL7150285 0.86 MAPT (0.46) MAPTGAALMNAKMT2AMEN1
SCHEMBL7150116 0.84 ALDH1A1 (0.45) MAPTGAAKMT2AMEN1CA12
SCHEMBL7151380 0.83 MAPT (0.41) MAPTGAALMNAKMT2AMEN1
SCHEMBL7147188 0.83 MEN1 (0.44) MAPTGAALMNAKMT2AMEN1
SCHEMBL7141597 0.81 MAPT (0.45) MAPTGAALMNAKMT2AMEN1
SCHEMBL7152599 0.81 MAPT (0.45) MAPTGAALMNAKMT2AMEN1
SCHEMBL7143275 0.81 MME (0.51) MAPTGAALMNAKMT2AMEN1

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-6541638-B2 (2S,4S)-1-(4-Mercapto-1-(naphthalene-2-sulfonyl)-pyrrolidine-2 -carbonyl)-piperidine-4-carboxylic acid ethyl ester for example; zinc protease inhibitors; for treating diseases associated with vasoconstriction HOFFMAN-LA ROCHE INC. 2003-04-01 US disclosed
US-20020049243-A1 Pyrrolidine derivatives HOFFMANN-LA ROCHE INC. 2002-04-25 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-20020049243-A1 Pyrrolidine derivatives PREP, PEPD, DNPEP MAPT 2428/4885GAA 130/4885LMNA 4821/4885

“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.