SCHEMBL451077

SCHEMBL451077

CCN(CC)C(=S)N(C)NS(=O)(=O)CC(=O)NN(C)C(=S)c1cnccn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
KDM4E B2RXH2 6/20 0.34
ALDH1A1 P00352 5/20 0.33
MAPT P10636 3/20 0.33
GAA P10253 3/20 0.33
RAB9A P51151 6/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
USP2 O75604 1/20 0.32
NPC1 O15118 4/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL449306 0.90 KDM4E (0.38) POLBKDM4EALDH1A1MAPTGAA
SCHEMBL449439 0.82 HSP90AA1 (0.51) POLBKDM4EALDH1A1MAPTGAA
SCHEMBL450180 0.82 HSP90AA1 (0.51) POLBKDM4EALDH1A1MAPTGAA
SCHEMBL2471081 0.81 POLB (0.37) POLBKDM4EALDH1A1MAPTGAA
SCHEMBL446308 0.73 HSP90AA1 (0.54) POLBALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL445921 0.71 HSP90AA1 (0.49) KDM4EALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL448855 0.71
SCHEMBL10228912 0.70 HSP90AA1 (0.54) KDM4EALDH1A1MAPTGAARAB9A
SCHEMBL451434 0.70 HSP90AA1 (0.54) KDM4EALDH1A1MAPTGAARAB9A
SCHEMBL450425 0.69 HSP90AA1 (0.55) KDM4EALDH1A1MAPTGAANPC1

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
US-8680100-B2 Sulfonylhydrazide compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-03-25 US disclosed
US-8680100-B2 Sulfonylhydrazide compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-03-25 US disclosed
US-20120065206-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-03-15 US disclosed
US-20120065206-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-03-15 US disclosed
EP-2370402-A2 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS Synta Pharmaceuticals Corp. (US) 2011-10-05 EP disclosed
WO-2010065512-A2 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2010-06-10 WO disclosed
WO-2010065512-A2 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2010-06-10 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-20120065206-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS PKD1, PKD2, PCNA POLB 92/4885KDM4E 3417/4885ALDH1A1 1351/4885

“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.