SCHEMBL480760

SCHEMBL480760

CN(C)/C=C/c1c([N+](=O)[O-])c(=O)n(C)c(=O)n1C

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
MAPT P10636 8/20 0.56
ALDH1A1 P00352 3/20 0.53
MAPK1 P28482 1/20 0.53
MITF O75030 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
KDM4E B2RXH2 2/20 0.44
GAA P10253 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
MMP14 P50281 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL480762 1.00 LMNA (0.67) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL18061430 0.81 LMNA (0.47) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL9535687 0.75 LMNA (0.40) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL4057528 0.74 MITF (0.74) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL4057527 0.74 MITF (0.74) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL24451139 0.72 MAPT (0.72) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL9537012 0.71 GAA (0.40) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL9535401 0.71 GAA (0.40) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL18120283 0.70 KDM4E (0.46) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL480656 0.70 KDM4E (0.53) LMNAMEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2708538-B1 Process for preparing fused pyrimidine-dione derivatives, useful as as TRPA1 modulators GLENMARK PHARMACEUTICALS SA (CH) 2015-08-12 EP disclosed
US-9000159-B2 Fused pyrimidine-dione derivatives as TRPA1 modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2015-04-07 US disclosed
US-20140128603-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS, S.A. (CH) 2014-05-08 US disclosed
EP-2708538-A1 Process for preparing fused pyrimidine-dione derivatives, useful as as TRPA1 modulators Glenmark Pharmaceuticals S.A. (CH) 2014-03-19 EP disclosed
EP-2411393-B1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2014-01-22 EP disclosed
US-8623880-B2 Fused pyrimidine-dione derivatives as TRPA1 modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2014-01-07 US disclosed
US-20120041004-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPAI MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2012-02-16 US disclosed
EP-2411393-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2012-02-01 EP disclosed
WO-2010109287-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2010-09-30 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 (2 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-20140128603-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS TRPA1, TRPV1, TRPV2 LMNA 2943/4885MEN1 4766/4885KMT2A 4283/4885
US-20120041004-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPAI MODULATORS TRPA1, TRPV1, TRPC3 LMNA 2534/4885MEN1 4615/4885KMT2A 4260/4885

“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.