SCHEMBL3328845

SCHEMBL3328845

Cc1ccc(S(=O)(=O)n2cc(-c3c[nH]c4ccc([N+](=O)[O-])cc34)c3ccccc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 1/20 0.47
UBE2N P61088 1/20 0.47
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
SLC6A4 P31645 1/20 0.45
HTR6 P50406 5/20 0.44
ALOX5 P09917 2/20 0.43
PTGS2 P35354 1/20 0.43
POLB P06746 1/20 0.43
ALK Q9UM73 1/20 0.42
KLK7 P49862 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP19A1 P11511 1/20 0.41
TNFSF11 O14788 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
SCHEMBL3334661 0.89 L3MBTL1 (0.64) L3MBTL1KDM4EUBE2NCA12CA9
SCHEMBL13302293 0.80 L3MBTL1 (0.52) L3MBTL1KDM4EUBE2NHTR6ALK
SCHEMBL13302225 0.75 HTR6 (0.57) HTR6
SCHEMBL13302232 0.74 L3MBTL1 (0.46) L3MBTL1KDM4EUBE2NHTR6
SCHEMBL4047708 0.73 CTSV (0.45) SLC6A4POLBMEN1KMT2A
SCHEMBL3336536 0.73 HTR6 (0.47) L3MBTL1KDM4EUBE2NHTR6ALK
SCHEMBL947461 0.73 HTR6 (0.50) L3MBTL1KDM4EUBE2NHTR6POLB
SCHEMBL28441278 0.72 KDM4E (0.63) L3MBTL1KDM4EUBE2NHTR6ALOX5
SCHEMBL949809 0.72 KDM4E (0.63) L3MBTL1KDM4EUBE2NCA9HTR6
SCHEMBL14406219 0.72 HTR6 (0.72) L3MBTL1CA12CA9HTR6MEN1

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-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
EP-2081892-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS Queen's University at Kingston (CA) 2009-07-29 EP disclosed
WO-2008058402-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2008-05-22 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-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS SNCA, MAPT, APP L3MBTL1 2503/4885KDM4E 1608/4885UBE2N 468/4885

“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.