SCHEMBL16615487

SCHEMBL16615487

CCCN(CCC)S(=O)(=O)c1ccc(NC(=O)Cc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
POLB P06746 3/20 0.69
NPSR1 Q6W5P4 2/20 0.69
GAA P10253 1/20 0.69
CTDSP1 Q9GZU7 2/20 0.67
MEN1 O00255 1/20 0.67
ESR1 P03372 1/20 0.67
KMT2A Q03164 1/20 0.67
RORC P51449 10/20 0.66
CA12 O43570 3/20 0.65
CA9 Q16790 3/20 0.65
CA1 P00915 2/20 0.65
PRMT1 Q99873 1/20 0.64
CA2 P00918 1/20 0.61
CA5A P35218 1/20 0.61
CA7 P43166 1/20 0.61
CA14 Q9ULX7 1/20 0.61
CA5B Q9Y2D0 1/20 0.61
ALDH1A1 P00352 2/20 0.60
LMNA P02545 1/20 0.60

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
SCHEMBL17947747 0.89 RORC (0.65) MAPTPOLBNPSR1GAARORC
SCHEMBL16615520 0.88 MAPT (0.66) MAPTPOLBNPSR1GAACTDSP1
SCHEMBL16615494 0.88 CA12 (0.70) MAPTPOLBNPSR1GAACTDSP1
SCHEMBL4189849 0.82 CA9 (0.68) MAPTPOLBNPSR1GAACTDSP1
SCHEMBL17947763 0.82 CA9 (0.90) MAPTPOLBNPSR1GAAMEN1
SCHEMBL17947769 0.81 POLB (1.00) MAPTPOLBNPSR1GAACTDSP1
SCHEMBL17055970 0.80 RORC (1.00) RORC
SCHEMBL28266789 0.80 RORC (1.00) RORC
SCHEMBL5466187 0.78 CA9 (0.67) MAPTPOLBNPSR1GAACA12
SCHEMBL16615524 0.77 SMN1; SMN2 (0.59) MAPTPOLBNPSR1GAACTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160213679-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF Université de Montréal (CA) 2016-07-28 US disclosed
US-20160213679-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF Université de Montréal (CA) 2016-07-28 US disclosed
WO-2015042685-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF VALORISATION-RECHERCHE (CA) 2015-04-02 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-20160213679-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF FBL, HNRNPA1, HNRNPUL1 MAPT 417/4885POLB 128/4885NPSR1 3361/4885

“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.