SCHEMBL7946093

SCHEMBL7946093

CN(C)S(=O)(=O)Oc1cncc(-c2cc3ccc(Cl)cc3[nH]2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 5/20 0.43
CDK5R1 Q15078 5/20 0.43
CYP11B2 P19099 1/20 0.40
CHEK2 O96017 1/20 0.38
PDGFRB P09619 1/20 0.36
FLT3 P36888 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
CA12 O43570 2/20 0.35
CA2 P00918 2/20 0.35
MEN1 O00255 3/20 0.34
NPC1 O15118 3/20 0.34
ALDH1A1 P00352 3/20 0.34
RAB9A P51151 3/20 0.34
KMT2A Q03164 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 2/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NFKB1 P19838 1/20 0.34

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
SCHEMBL1606467 0.88 CDK5 (0.41) CDK5CDK5R1CHEK2PDGFRBFLT3
SCHEMBL1606854 0.80 CDK5 (0.39) CDK5CDK5R1CHEK2PTGDR2NPC1
SCHEMBL28787691 0.79 CDK5 (0.41) CDK5CDK5R1CYP11B2CHEK2PTGDR2
SCHEMBL1606949 0.78 CYP11B1 (0.48) CDK5CDK5R1CYP11B2CHEK2PTGDR2
SCHEMBL7951268 0.76 CDK5 (0.54) CDK5CDK5R1CHEK2PTGDR2MEN1
SCHEMBL1606017 0.75 CDK5 (0.44) CDK5CDK5R1CYP11B2CHEK2PTGDR2
SCHEMBL7947331 0.75 CYP11B2 (0.48) CYP11B2CA12CA2MEN1NPC1
SCHEMBL1606038 0.74 CDK5 (0.49) CDK5CDK5R1CHEK2PTGDR2MEN1
SCHEMBL1605929 0.72 RAB9A (0.44) CDK5CDK5R1PTGDR2MEN1NPC1
SCHEMBL1606743 0.71 CYP11B2 (0.45) CDK5CDK5R1CYP11B2PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242963-B2 Organic compounds NOVARTIS AG (CH) 2016-01-26 US disclosed
US-9242963-B2 Organic compounds NOVARTIS AG (CH) 2016-01-26 US disclosed
US-20150210672-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2015-07-30 US disclosed
US-20150210672-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2015-07-30 US disclosed
US-20140288126-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-09-25 US disclosed
US-20140288126-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-09-25 US disclosed
US-8791141-B2 Organic compounds NOVARTIS AG (CH) 2014-07-29 US disclosed
US-8791141-B2 Organic compounds NOVARTIS AG (CH) 2014-07-29 US disclosed
US-8030334-B2 Organic compounds NOVARTIS AG (CH) 2011-10-04 US disclosed
US-20110082129-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-04-07 US disclosed
US-20110082129-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-04-07 US disclosed
US-20100261698-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-10-14 US disclosed
WO-2009156462-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-30 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 (4 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-20110082129-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CDK5 2743/4885CDK5R1 2894/4885CYP11B2 13/4885
US-20100261698-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CDK5 2743/4885CDK5R1 2894/4885CYP11B2 13/4885
US-20150210672-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CDK5 2464/4885CDK5R1 2947/4885CYP11B2 12/4885
US-20140288126-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CDK5 2464/4885CDK5R1 2947/4885CYP11B2 12/4885

“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.