SCHEMBL5166733

SCHEMBL5166733

COC(=O)c1cn(-c2cc3c(=O)[nH]c(=O)n(NS(=O)(=O)c4ccccc4)c3cc2C(F)(F)F)cn1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
ADORA3 P0DMS8 1/20 0.33

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
SCHEMBL5463670 0.92 GRIA1 (0.35) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL5166010 0.88 CA12 (0.42) MEN1KMT2AGRIA1GRIA2GRIA3
SCHEMBL5167535 0.79 CA12 (0.45) GRIA1GRIA2GRIA3GRIA4
SCHEMBL13685430 0.76 CA12 (0.42) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5165036 0.76 CA12 (0.46) MEN1KMT2AGRIA1GRIA2GRIA3
SCHEMBL13685370 0.74 CA12 (0.43) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5168639 0.69 CA12 (0.48) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5216319 0.66 CA12 (0.47) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5167753 0.66 CA12 (0.46) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5165199 0.65 CFTR (0.53) RBP4MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773788-B1 Quinazoline derivatives NOVARTIS AG (CH) 2012-11-14 EP claimed
US-8299085-B2 Quinazoline derivatives NOVARTIS AG (CH) 2012-10-30 US claimed
EP-1773788-B1 Quinazoline derivatives NOVARTIS AG (CH) 2012-11-14 EP disclosed
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 RBP4 4803/4885MEN1 1459/4885KMT2A 2522/4885

“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.