SCHEMBL2767286

SCHEMBL2767286

NSOc1cccc(N2Cc3ccc(OSN)cc3OC2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.45
NPC1 O15118 2/20 0.33
TP53 P04637 2/20 0.33
TSHR P16473 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
PARP1 P09874 1/20 0.32
SLC9A3 P48764 1/20 0.31
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
KCNH2 Q12809 1/20 0.31
FADS1 O60427 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
SCHEMBL2765598 0.93 MIF (0.42) MIFNPC1TSHRRAB9AGAA
SCHEMBL2767228 0.90 MIF (0.46) MIFNPC1RAB9AHDAC3HDAC1
SCHEMBL2766527 0.85 MIF (0.54) MIFNPC1RAB9AHDAC3HDAC1
SCHEMBL2766407 0.85 MIF (0.51) MIFNPC1TP53RAB9A
SCHEMBL3546808 0.81 CA2 (0.45) MIF
SCHEMBL2766883 0.81 MIF (0.60) MIFNPC1RAB9AHDAC3HDAC1
SCHEMBL2765545 0.75 MIF (0.53) MIFNPC1TP53RAB9ASMN1; SMN2
SCHEMBL2768482 0.75 GRM2 (0.38) HDAC1PARP1DRD3KCNH2
SCHEMBL2766273 0.74 STS (0.43) MIF
SCHEMBL3545651 0.74 MIF (0.52) MIFGAAFADS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1805170-B1 MIF-INHIBITORS NOVARTIS AG (CH) 2010-04-14 EP disclosed
US-7378416-B2 MIF-inhibitors NOVARTIS AG (CH) 2008-05-27 US disclosed
US-20070219189-A1 MIF-INHIBITORS NOVARTIS AG (CH) 2007-09-20 US 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-20070219189-A1 MIF-INHIBITORS MIF, FOXM1, CCR8 MIF 1/4885NPC1 2226/4885TP53 1142/4885

“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.