SCHEMBL3196262

SCHEMBL3196262

O=C1C(=CC=CC=C2Sc3ccccc3N2CCCS(=O)(=O)O)S(=O)(=O)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 3/20 0.42
▸ MEN1 O00255 11/20 0.42
▸ KMT2A Q03164 11/20 0.42
▸ MAPT P10636 11/20 0.42
▸ POLB P06746 5/20 0.42
▸ HPGD P15428 4/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ DUSP3 P51452 1/20 0.41
▸ ALDH1A1 P00352 6/20 0.40
▸ ALOX15 P16050 4/20 0.40
▸ TDP1 Q9NUW8 4/20 0.40
▸ ALOX12 P18054 3/20 0.40
▸ CASP1 P29466 3/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ LMNA P02545 3/20 0.40
▸ CASP7 P55210 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ CTDSP1 Q9GZU7 2/20 0.39

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
SCHEMBL3196246 1.00 MMP13 (0.42) MMP13MEN1KMT2AMAPTPOLB
SCHEMBL4503910 0.90 MMP13 (0.42) MMP13MEN1KMT2AMAPTPOLB
SCHEMBL4503906 0.90 KDM4E (0.52) MMP13MEN1KMT2AMAPTPOLB
SCHEMBL4503913 0.90 KDM4E (0.52) MMP13MEN1KMT2AMAPTPOLB
SCHEMBL13292509 0.84 MEN1 (0.39) MMP13MEN1KMT2AMAPTPOLB
SCHEMBL13483760 0.84 MEN1 (0.40) MMP13MEN1KMT2AMAPTPOLB
SCHEMBL4500369 0.83 MEN1 (0.49) MEN1KMT2AMAPTPOLBHPGD
SCHEMBL2057356 0.83 MEN1 (0.49) MEN1KMT2AMAPTPOLBHPGD
SCHEMBL2057354 0.83 MEN1 (0.49) MEN1KMT2AMAPTPOLBHPGD
SCHEMBL2057351 0.83 MEN1 (0.49) MEN1KMT2AMAPTPOLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745377-B2 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation THE SCRIPPS RESEARCH INSTITUTE (US) 2010-06-29 — — US disclosed
US-7662644-B2 Use of specified fluorescent dyes to conjugate to antibody; detecting binding of an antibody to an antigen; antibody conjugate THE SCRIPPS RESEARCH INSTITUTE (US) 2010-02-16 — — US disclosed
US-20070218502-A1 LABELED PEPTIDES, PROTEINS AND ANTIBODIES AND PROCESSES AND INTERMEDIATES USEFUL FOR THEIR PREPARATION THE SCRIPPS RESEARCH INSTITUTE 2007-09-20 — — US disclosed
US-7176037-B2 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation THE SCRIPPS RESEARCH INSTITUTE (US) 2007-02-13 — — US disclosed
US-20050287518-A1 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation THE SCRIPPS RESEARCH INSTITUTE 2005-12-29 — — US disclosed
US-6951947-B2 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation THE SCRIPPS RESEARCH INSTITUTE (US) 2005-10-04 — — US disclosed
US-20040067537-A1 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation HAHN KLAUS M (US) 2004-04-08 — — US disclosed
US-20020055133-A1 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation SCRIPPS RESEARCH INSTITUTE, THE 2002-05-09 — — 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 (4 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-20020055133-A1 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation ARHGEF1, RHOC, CIT MMP13 3420/4885MEN1 1305/4885KMT2A 4697/4885
US-20040067537-A1 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation CIT, RHOC, ARHGEF1 MMP13 3456/4885MEN1 1276/4885KMT2A 4693/4885
US-20070218502-A1 LABELED PEPTIDES, PROTEINS AND ANTIBODIES AND PROCESSES AND INTERMEDIATES USEFUL FOR THEIR PREPARATION CIT, RHOC, ARHGEF1 MMP13 3456/4885MEN1 1276/4885KMT2A 4693/4885
US-20050287518-A1 Labeled peptides, proteins and antibodies and processes and intermediates useful for their preparation ARHGEF1, RHOC, CIT MMP13 3420/4885MEN1 1305/4885KMT2A 4697/4885

“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.

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