SCHEMBL4285030

SCHEMBL4285030

CC(NC(=O)c1ccccc1[N+](=O)[O-])c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.64
MAPT P10636 3/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
ALDH1A1 P00352 7/20 0.61
KDM4E B2RXH2 4/20 0.61
HPGD P15428 3/20 0.61
HSD17B10 Q99714 2/20 0.61
CTSD P07339 1/20 0.56
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C19 P33261 2/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
GLA P06280 1/20 0.53
HTT P42858 1/20 0.52
POLB P06746 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL4285026 1.00 LMNA (0.64) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL27582258 0.89 ALDH1A1 (0.56) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL31681471 0.88 LMNA (0.55) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL13761295 0.84 ALDH1A1 (0.67) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL18767074 0.84 POLB (0.68) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL18767075 0.84 MAPT (0.57) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL513385 0.84 ALDH1A1 (0.61) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL8026101 0.83 ALDH1A1 (0.65) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL18767073 0.81 MAPT (0.54) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL29018147 0.80 CTSD (0.57) LMNAMAPTMEN1KMT2AALDH1A1

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
US-20090137681-A1 Sirtuin Inhibiting Compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2009-05-28 US disclosed
US-20090137681-A1 Sirtuin Inhibiting Compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2009-05-28 US disclosed
US-20090137681-A1 Sirtuin Inhibiting Compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2009-05-28 US disclosed
WO-2007084162-A2 SIRTUIN INHIBITING COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-07-26 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-20090137681-A1 Sirtuin Inhibiting Compounds SIRT2, SIRT1, SIRT3 LMNA 1961/4885MAPT 2630/4885MEN1 320/4885

“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.