SCHEMBL6475605

SCHEMBL6475605

CCCCN1CCc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN12 Q05209 1/20 0.53
PTPN22 Q9Y2R2 1/20 0.53
AKR1B1 P15121 8/20 0.52
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
PTPN1 P18031 3/20 0.49
MMP3 P08254 2/20 0.49
MMP13 P45452 2/20 0.49
PDE4B Q07343 1/20 0.49
KMT2A Q03164 3/20 0.49
ADAMTS5 Q9UNA0 1/20 0.49
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL6474686 1.00 PTPN12 (0.53) PTPN12PTPN22AKR1B1APOBEC3AAPOBEC3G
SCHEMBL13170392 0.96 PTPN12 (0.51) PTPN12PTPN22AKR1B1APOBEC3AAPOBEC3G
SCHEMBL6476411 0.95 PTPN12 (0.53) PTPN12PTPN22AKR1B1PTPN1MMP3
SCHEMBL6476416 0.95 PTPN12 (0.53) PTPN12PTPN22AKR1B1PTPN1MMP3
SCHEMBL13345948 0.91 PTPN12 (0.52) PTPN12PTPN22AKR1B1PTPN1MMP3
SCHEMBL11978766 0.91 PTPN12 (0.56) PTPN12PTPN22AKR1B1PTPN1MMP3
SCHEMBL6475342 0.87 FABP4 (0.54) AKR1B1KMT2AADAMTS5MEN1MAPT
SCHEMBL6475339 0.87 FABP4 (0.54) AKR1B1KMT2AADAMTS5MEN1MAPT
SCHEMBL6482725 0.86 CTNNB1 (0.57) PTPN12PTPN22KMT2AMEN1MAPT
SCHEMBL6482730 0.86 CTNNB1 (0.57) PTPN12PTPN22KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1225886-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-07-31 EP claimed
EP-1192143-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-04-03 EP claimed
WO-2000076987-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 WO claimed
WO-2000076489-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 WO claimed
US-6972287-B1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits PFIZER INC. (US) 2005-12-06 US disclosed
US-20040220235-A1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits AUGELLI-SZAFRAN CORINNE ELIZAB (US) 2004-11-04 US disclosed
EP-1225886-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-07-31 EP disclosed
EP-1192143-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-04-03 EP disclosed
WO-2000076987-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 WO disclosed
WO-2000076489-A2 METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 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-20040220235-A1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits APP, PSEN1, BACE1 PTPN12 4853/4885PTPN22 4772/4885AKR1B1 2199/4885

“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.