SCHEMBL2184586

SCHEMBL2184586

CC(=O)c1cc(Cl)ncc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ CRHBP P24387 1/20 0.47
▸ CRHR2 Q13324 1/20 0.47
▸ CYTH2 Q99418 1/20 0.46
▸ FLT1 P17948 2/20 0.45
▸ FLT4 P35916 2/20 0.45
▸ KDR P35968 2/20 0.45
▸ NFKBIA P25963 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ LMNA P02545 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ CCR9 P51686 1/20 0.43
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43

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
SCHEMBL13457662 0.84 LMNA (0.46) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL12367217 0.79 RAB9A (0.49) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL2184619 0.77 CA12 (0.44) MEN1KMT2AALDH1A1FLT1FLT4
SCHEMBL11405994 0.75 CRHBP (0.53) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL13457574 0.71 TDP1 (0.50) MEN1KMT2ATDP1ALDH1A1CYP3A4
SCHEMBL12367220 0.70 MAOB (0.40) MEN1KMT2ACRHBPCRHR2MAPK1
SCHEMBL30287096 0.70 CA12 (0.43) MEN1KMT2ACYP3A4LMNAMAPK1
SCHEMBL2185789 0.70 CA12 (0.43) MEN1KMT2ACYP3A4LMNAMAPK1
SCHEMBL12839891 0.69 HSD17B2 (0.64) MEN1KMT2ATDP1ALDH1A1CRHBP
SCHEMBL789641 0.68 MEN1 (0.52) MEN1KMT2ATDP1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102203075-B Bicyclic kinase inhibitors NOVARTIS AG 2014-09-10 — — CN disclosed
US-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 — — US disclosed
US-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 — — US disclosed
CN-102203075-A Bicyclic kinase inhibitors NOVARTIS AG 2011-09-28 — — CN disclosed
US-20110195980-A1 Bicyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 — — US disclosed
US-20110195980-A1 Bicyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 — — US disclosed
EP-2342190-A1 BICYCLIC KINASE INHIBITORS Novartis AG (CH) 2011-07-13 — — EP disclosed
WO-2010026121-A1 BICYCLIC KINASE INHIBITORS NOVARTIS AG (CH) 2010-03-11 — — 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-20110195980-A1 Bicyclic Kinase Inhibitors PIM1, PIM2, PIM3 MEN1 3443/4885KMT2A 481/4885TDP1 591/4885

“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.

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