SCHEMBL3462584

SCHEMBL3462584

Cc1ccc(NC(=O)NCc2ccccc2)cc1[N+](=O)[O-]

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.76
KMT2A Q03164 9/20 0.76
MAPT P10636 7/20 0.76
SMN1; SMN2 Q16637 5/20 0.76
HPGD P15428 2/20 0.76
RAB9A P51151 4/20 0.72
LMNA P02545 4/20 0.72
NPC1 O15118 3/20 0.72
MAPK1 P28482 1/20 0.72
ALOX12 P18054 1/20 0.62
TP53 P04637 1/20 0.52
HTT P42858 3/20 0.51
GAA P10253 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
NAMPT P43490 1/20 0.51
GSK3B P49841 1/20 0.51
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL4354177 0.86 MEN1 (0.57) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL6672203 0.84 MEN1 (0.56) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL1504555 0.84 MEN1 (1.00) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL11326938 0.82 KMT2A (0.85) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL18702851 0.82 KMT2A (0.68) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL29502867 0.82 KMT2A (0.68) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL18702632 0.81 MEN1 (0.67) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL23135815 0.80 RAB9A (0.58) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL5314210 0.80 KMT2A (0.64) MEN1KMT2AMAPTSMN1; SMN2HPGD
SCHEMBL10318606 0.80 ALDH1A1 (0.71) MEN1KMT2AMAPTSMN1; SMN2HPGD

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-20120196884-A1 UREA SUBSTITUTED SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORPORATION (FI) 2012-08-02 US disclosed
US-20120196884-A1 UREA SUBSTITUTED SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORPORATION (FI) 2012-08-02 US disclosed
WO-2010146236-A1 UREA SUBSTITUTED SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORP. (FI) 2010-12-23 WO disclosed
WO-2010146236-A1 UREA SUBSTITUTED SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORP. (FI) 2010-12-23 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-20120196884-A1 UREA SUBSTITUTED SULPHONAMIDE DERIVATIVES ITGA1, ITGB1, ITGA2B MEN1 4730/4885KMT2A 2144/4885MAPT 2831/4885

“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.