SCHEMBL5166116

SCHEMBL5166116

CC(CO)Nc1cc2c(=O)n(NS(C)(=O)=O)c(=O)[nH]c2cc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.37
CA9 Q16790 4/20 0.37
ALDH1A1 P00352 3/20 0.35
MAPT P10636 4/20 0.35
HCAR3 P49019 2/20 0.34
POLB P06746 2/20 0.32
GAA P10253 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH3A1 P30838 1/20 0.31

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
SCHEMBL5179039 1.00 CA12 (0.37) CA12CA9ALDH1A1MAPTHCAR3
SCHEMBL5165860 0.91 CA12 (0.38) CA12CA9ALDH1A1MAPTHCAR3
SCHEMBL5460988 0.90 CA12 (0.36) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL5179666 0.89 CA12 (0.38) CA12CA9ALDH1A1MAPTHCAR3
SCHEMBL5168506 0.89 MAPT (0.43) CA12CA9ALDH1A1MAPTHCAR3
SCHEMBL5181861 0.89 HCAR3 (0.43) CA12CA9ALDH1A1MAPTHCAR3
SCHEMBL5469340 0.86 BDKRB1 (0.39) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL5179791 0.86 BDKRB1 (0.39) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL5179797 0.86 BDKRB1 (0.39) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL5168261 0.85 MAPT (0.36) CA12CA9ALDH1A1MAPTHCAR3

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-8299085-B2 Quinazoline derivatives NOVARTIS AG (CH) 2012-10-30 US disclosed
US-20070208018-A1 Quinazoline Derivatives NOVARTIS AG (CH) 2007-09-06 US disclosed
EP-1773788-A2 QUINAZOLINE DERIVATIVES NOVARTIS-PHARMA GMBH (AT) 2007-04-18 EP disclosed
WO-2006010591-A2 QUINAZOLINE DERIVATIVES NOVARTIS AG (CH) 2006-02-02 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-20070208018-A1 Quinazoline Derivatives CYP3A5, CYP3A7, CYP3A4 CA12 4138/4885CA9 2807/4885ALDH1A1 460/4885

“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.