SCHEMBL6470802

SCHEMBL6470802

Cc1ccc(Cn2c(=O)c3cc(C(=O)OCc4ccccc4)sc3n(C)c2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.48
MMP13 P45452 1/20 0.48
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 2/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ESR1 P03372 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42

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
SCHEMBL6252686 0.95 MMP13 (0.53) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6533924 0.93 MMP13 (0.49) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6730796 0.93 MMP13 (0.49) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6258183 0.92 MMP13 (0.48) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6730265 0.92 MMP13 (0.48) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6476942 0.92 MMP13 (0.48) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6724753 0.92 MMP13 (0.48) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6470824 0.91 MMP13 (0.50) TRPA1MMP13MEN1KMT2ALMNA
SCHEMBL6258115 0.91 TRPA1 (0.49) TRPA1MMP13LMNASMN1; SMN2ALDH1A1
SCHEMBL6730594 0.91 MMP13 (0.48) TRPA1MMP13MEN1KMT2ALMNA

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370562-A1 THIENO[2,3-D]PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-12-17 EP claimed
EP-0927273-B1 PHENOLIC STAIN-RESISTS DU PONT (US) 2003-03-12 EP claimed
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 US claimed
WO-2002064598-A1 THIENO'2,3-D PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed
EP-0891413-A1 PREVENTION OF DYE-BLEEDING AND TRANSFER DURING LAUNDERING E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-01-20 EP claimed
US-5725889-A TO ACID DYES, POLYAMIDE FIBERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-03-10 US claimed
US-5707949-A DETERGENT ADDITIVE, RESOLE FROM BIS(HYDROXYPHENYL)SULFONE AND FORMALDEHYDE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-01-13 US claimed
EP-0682726-B1 BIS(HYDROXYPHENYL)SULFONE RESOLES AS POLYAMIDE STAIN-RESISTS DU PONT (US) 1997-12-03 EP claimed
WO-1997038077-A1 PREVENTION OF DYE-BLEEDING AND TRANSFER DURING LAUNDERING E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-10-16 WO claimed
EP-0682726-A1 BIS(HYDROXYPHENYL)SULFONE RESOLES AS POLYAMIDE STAIN-RESISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-11-22 EP claimed
US-5460891-A Resoles from fromaldehyde and bis(hydroxyphenyl) sulfone E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-10-24 US claimed
US-5447755-A Applying to polyamide substrates, base catalyzed resole of of sulfone with formaldehyde E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-09-05 US claimed
WO-1994018378-A1 BIS(HYDROXYPHENYL)SULFONE RESOLES AS POLYAMIDE STAIN-RESISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-08-18 WO claimed
EP-1585749-A1 DIAZEPINOINDOLE DERIVATIVES AS KINASE INHIBITORS PFIZER INC. (US) 2005-10-19 EP disclosed
EP-1530475-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING AN ALLOSTERIC CARBOXYLIC INHIBITOR OF MATRIX METALLOPROTEINASE-13 AND A SELECTIVE INHIBITOR OF CYCLOOXYGENASE-2 Warner-Lambert Company LLC (US) 2005-05-18 EP disclosed
WO-2004063198-A1 DIAZEPINOINDOLE DERIVATIVES AS KINASE INHIBITORS PFIZER INC. (US) 2004-07-29 WO disclosed
EP-0682726-A1 BIS(HYDROXYPHENYL)SULFONE RESOLES AS POLYAMIDE STAIN-RESISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-11-22 EP disclosed
US-5460891-A Resoles from fromaldehyde and bis(hydroxyphenyl) sulfone E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-10-24 US disclosed
US-5447755-A Applying to polyamide substrates, base catalyzed resole of of sulfone with formaldehyde E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-09-05 US disclosed
WO-1994018378-A1 BIS(HYDROXYPHENYL)SULFONE RESOLES AS POLYAMIDE STAIN-RESISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-08-18 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-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors MMP13, MMP3, MMP25 TRPA1 3888/4885MMP13 1/4885MEN1 3056/4885

“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.