SCHEMBL7141907

SCHEMBL7141907

CCOC(=O)c1ccc(NC(=O)CN(C)C(=O)C2CC(S)CN2S(=O)(=O)Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.52
GAA P10253 5/20 0.52
MME P08473 1/20 0.48
ACE P12821 1/20 0.48
ECE1 P42892 1/20 0.48
LMNA P02545 1/20 0.46
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
MAPK1 P28482 4/20 0.43
ALDH1A1 P00352 4/20 0.42
TP53 P04637 1/20 0.42
NAMPT P43490 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL7148177 1.00 MAPT (0.52) MAPTGAAMMEACEECE1
SCHEMBL7136104 0.93 MAPT (0.46) MAPTGAAMMEACEECE1
SCHEMBL7150285 0.93 MAPT (0.46) MAPTGAAMMEACEECE1
SCHEMBL7152599 0.91 MAPT (0.45) MAPTGAAMMEACEECE1
SCHEMBL7141597 0.91 MAPT (0.45) MAPTGAAMMEACEECE1
SCHEMBL7140974 0.90 MME (0.47) MAPTGAAMMEACEECE1
SCHEMBL7140980 0.90 MME (0.47) MAPTGAAMMEACEECE1
SCHEMBL7150121 0.89 MME (0.46) MAPTGAAMMEACEECE1
SCHEMBL7143653 0.87 MAPT (0.62) MAPTGAALMNACA12CA9
SCHEMBL7142910 0.87 MAPT (0.62) MAPTGAALMNACA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1303485-A1 PYRROLIDINE DERIVATIVES AS INHIBITORS OF ENDOTHELIN-CONVERTING ENZYME F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP disclosed
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
WO-2002006222-A1 PYRROLIDINE DERIVATIVES AS INHIBITORS OF ENDOTHELIN-CONVERTING ENZYME F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 WO 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 130/4885MME 99/4885

“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.