SCHEMBL5484204

SCHEMBL5484204

COc1ccccc1N1C(=O)CCN(Cc2ccc([N+](=O)[O-])cc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPK1 P28482 2/20 0.48
LMNA P02545 1/20 0.48
ADRA1D P25100 2/20 0.45
ADRA1A P35348 2/20 0.45
ADRA1B P35368 2/20 0.45
POLB P06746 1/20 0.45
HTR1A P08908 2/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
ABCC1 P33527 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HTT P42858 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
SCHEMBL5475968 0.86 POLB (0.50) MAPTALDH1A1MAPK1LMNAPOLB
SCHEMBL5470632 0.84 POLB (0.51) SMN1; SMN2MAPTMAPK1ADRA1DADRA1A
SCHEMBL5480364 0.84 ALDH1A1 (0.51) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL5474612 0.78 ALDH1A1 (0.50) SMN1; SMN2MAPTALDH1A1LMNAPOLB
SCHEMBL11556531 0.75 MAPK1 (0.69) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL5481627 0.75 POLB (0.52) SMN1; SMN2MAPTALDH1A1LMNAPOLB
SCHEMBL5470893 0.74 MAPT (0.47) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL31011703 0.72 KDM4E (0.57) SMN1; SMN2MAPTALDH1A1LMNAPOLB
SCHEMBL11358481 0.71 MAPT (0.55) SMN1; SMN2MAPTALDH1A1MEN1KMT2A
SCHEMBL5484208 0.70 MAPT (0.45) SMN1; SMN2MAPTALDH1A1MAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010529-A1 Nitrogenous heterocyclic compounds and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-11 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-20070010529-A1 Nitrogenous heterocyclic compounds and medical use thereof MAPK1, NOS1, NOS2 SMN1; SMN2 1822/4885MAPT 1199/4885ALDH1A1 1694/4885

“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.