SCHEMBL5452660

SCHEMBL5452660

NC(=O)c1c(NC(=O)Nc2cccc([N+](=O)[O-])c2)sc2c1CCOC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.53
CFTR P13569 1/20 0.52
MEN1 O00255 8/20 0.51
KMT2A Q03164 8/20 0.51
MAPT P10636 4/20 0.51
POLB P06746 3/20 0.51
HTT P42858 3/20 0.51
DDX3X O00571 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.51
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
EPHB4 P54760 1/20 0.50
BAZ1A Q9NRL2 2/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
GAA P10253 2/20 0.45

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
SCHEMBL5457807 0.88 CFTR (0.55) CFTRMEN1KMT2ANPC1RAB9A
SCHEMBL5460669 0.86 PDE4B (0.58) PDE4BCFTRMEN1KMT2AMAPT
SCHEMBL5467205 0.85 CFTR (0.56) CFTRMEN1KMT2AMAPTHTT
SCHEMBL5454365 0.84 CFTR (0.55) CFTRMEN1KMT2AMAPTHTT
SCHEMBL5457654 0.84 CFTR (0.55) CFTRMEN1KMT2AMAPTHTT
SCHEMBL5448351 0.84 CFTR (0.55) CFTRMEN1KMT2AMAPTHTT
SCHEMBL5451652 0.84 CFTR (0.60) CFTRMEN1KMT2AMAPTHTT
SCHEMBL5455947 0.84 MEN1 (0.65) CFTRMEN1KMT2AMAPTNPC1
SCHEMBL5466862 0.83 CFTR (0.57) CFTRMEN1KMT2AMAPTHTT
SCHEMBL5457889 0.83 CFTR (0.55) PDE4BCFTRMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 US claimed
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 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-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents TBCA, PARK7, NFATC1 PDE4B 1387/4885CFTR 2030/4885MEN1 2891/4885

“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.