SCHEMBL5246257

SCHEMBL5246257

COc1ccc(-c2ccc([N+](=O)[O-])c3nonc23)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.63
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
GSTP1 P09211 3/20 0.48
GSTM2 P28161 2/20 0.48
HTR7 P34969 1/20 0.48
MYC P01106 4/20 0.47
MAX P61244 3/20 0.47
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
TNNI3 P19429 1/20 0.46
TNNT2 P45379 1/20 0.46
TNNC1 P63316 1/20 0.46
XDH P47989 1/20 0.43

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
SCHEMBL4787667 0.84 MEN1 (0.63) IDO1MEN1KMT2ANPC1RAB9A
SCHEMBL5246953 0.84 IDO1 (0.60) IDO1MEN1KMT2AGSTP1GSTM2
SCHEMBL5304188 0.84 MYC (0.54) IDO1MEN1KMT2AGSTP1GSTM2
SCHEMBL5285112 0.83 MEN1 (0.53) IDO1MEN1KMT2ANPC1RAB9A
SCHEMBL5244876 0.81 IDO1 (0.60) IDO1MEN1KMT2AGSTP1GSTM2
SCHEMBL5243642 0.81 MYC (0.67) IDO1MEN1KMT2AGSTP1GSTM2
SCHEMBL4787863 0.81 GSTP1 (0.55) IDO1MEN1KMT2AGSTP1GSTM2
SCHEMBL4787663 0.81 IDO1 (0.53) IDO1MEN1KMT2AGSTP1GSTM2
SCHEMBL22443902 0.81 HTR7 (0.48) IDO1MEN1KMT2ANPC1RAB9A
SCHEMBL18896943 0.81 IDO1 (0.63) IDO1MEN1KMT2ANPC1RAB9A

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 IDO1 805/4885MEN1 3562/4885KMT2A 1303/4885

“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.