SCHEMBL5281465

SCHEMBL5281465

O=[N+]([O-])c1ccc(Sc2nc3ccccc3s2)c2nonc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 7/20 0.62
GSTM2 P28161 7/20 0.62
MAPT P10636 8/20 0.59
LMNA P02545 5/20 0.59
KMT2A Q03164 5/20 0.59
HTT P42858 4/20 0.59
PKM P14618 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
NPC1 O15118 2/20 0.59
MAPK1 P28482 2/20 0.59
TP53 P04637 1/20 0.59
HPGD P15428 5/20 0.57
ALDH1A1 P00352 5/20 0.57
NPSR1 Q6W5P4 5/20 0.57
AGTR1 P30556 4/20 0.57
TLR9 Q9NR96 3/20 0.57
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 2/20 0.57

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
SCHEMBL3506038 0.86 MAPT (0.59) GSTP1GSTM2MAPTLMNAKMT2A
SCHEMBL18878890 0.79 GSTP1 (0.77) GSTP1GSTM2MAPTKMT2AHTT
SCHEMBL137897 0.78 MAPT (0.71) MAPTLMNAKMT2AHTTPKM
SCHEMBL29405540 0.78 MAPT (0.71) MAPTLMNAKMT2AHTTPKM
SCHEMBL5244464 0.77 GSTP1 (0.63) GSTP1GSTM2MAPTLMNAKMT2A
SCHEMBL13236138 0.77 MAPT (0.60) MAPTLMNAKMT2AHTTPKM
SCHEMBL6836307 0.77 GSTP1 (1.00) GSTP1GSTM2MAPTKMT2AHTT
SCHEMBL10752315 0.77 MAPT (0.63) MAPTLMNAKMT2AHTTPKM
SCHEMBL11366224 0.76 MAPT (0.69) MAPTLMNAKMT2AHTTPKM
SCHEMBL13355661 0.74 MAPT (0.66) MAPTLMNAKMT2AHTTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758873-A1 UBIQUITIN LIGASE INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2007-03-07 EP claimed
WO-2006002284-A1 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2006-01-05 WO claimed
US-20050282818-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 US claimed
US-20050282818-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 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 (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-20050282818-A1 Ubiquitin ligase inhibitors NEDD4, TRAF6, XIAP GSTP1 2061/4885GSTM2 2584/4885MAPT 1681/4885

“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.