SCHEMBL5455310

SCHEMBL5455310

CCCCCCCCCCCCCCCCCCCNc1ccc(S(=O)(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.70
PKM P14618 3/20 0.70
POLB P06746 2/20 0.70
HCAR3 P49019 3/20 0.65
LMNA P02545 3/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MAPK1 P28482 1/20 0.62
PRSS1 P07477 2/20 0.54
PTPN22 Q9Y2R2 1/20 0.51
KAT2B Q92831 3/20 0.50
WNK1 Q9H4A3 1/20 0.50
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL6515604 0.88 MAPT (0.69) MAPTPKMPOLBHCAR3LMNA
SCHEMBL18116062 0.86 MAPT (0.59) MAPTPKMPOLBHCAR3LMNA
SCHEMBL197978 0.83 PKM (0.67) MAPTPKMPOLBLMNASMN1; SMN2
SCHEMBL29516580 0.83 PKM (0.67) MAPTPKMPOLBLMNASMN1; SMN2
SCHEMBL12760575 0.83 MAPT (0.62) MAPTPKMPOLBHCAR3LMNA
SCHEMBL16151564 0.82 KAT2B (0.72) MAPTPKMPOLBHCAR3LMNA
SCHEMBL20968369 0.82 HCAR3 (0.66) MAPTPKMPOLBHCAR3LMNA
SCHEMBL16152114 0.82 HCAR3 (0.66) MAPTPKMPOLBHCAR3LMNA
SCHEMBL10428098 0.82 HCAR3 (0.66) MAPTPKMPOLBHCAR3LMNA
SCHEMBL10895100 0.82 HCAR3 (0.70) MAPTPKMPOLBHCAR3LMNA

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-20070185176-A1 Heparanase inhibitors and uses thereof INSIGHT BIOHARMACEUTICALS LTD. (IL) 2007-08-09 US disclosed
EP-1720828-A2 HEPARANASE INHIBITORS AND USES THEREOF Insight Biopharmaceuticals Ltd (IL) 2006-11-15 EP disclosed
WO-2005074375-A2 HEPARANASE INHIBITORS AND USES THEREOF INSIGHT BIOPHARMACEUTICALS LTD (IL) 2005-08-18 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-20070185176-A1 Heparanase inhibitors and uses thereof HPSE, ENGASE, HEXA MAPT 4234/4885PKM 3794/4885POLB 3716/4885

“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.