SCHEMBL564364

SCHEMBL564364

CS(=O)(=O)c1ccc(Oc2ccc3[nH]c(C(N)=S)cc3c2)cn1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
XDH P47989 1/20 0.42
LGALS8 O00214 9/20 0.41
LGALS3 P17931 8/20 0.41
FLT3 P36888 3/20 0.40
PDGFRB P09619 3/20 0.40
PDGFRA P16234 3/20 0.40
LGALS1 P09382 1/20 0.36

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
SCHEMBL564765 0.90 KMT2A (0.46) KMT2AXDHLGALS8LGALS3FLT3
SCHEMBL564651 0.86 KMT2A (0.60) KMT2AXDHLGALS8LGALS3FLT3
SCHEMBL563627 0.84 GCK (0.33) XDH
SCHEMBL1075818 0.82 GCK (0.33) XDH
SCHEMBL563631 0.82 GCK (0.34)
SCHEMBL564842 0.82 KDM4E (0.60) KMT2AXDHLGALS8LGALS3
SCHEMBL1075410 0.81 GCK (0.34) PDGFRBPDGFRA
SCHEMBL564250 0.77 GCK (0.36)
SCHEMBL1078187 0.76 GCK (0.34)
SCHEMBL564574 0.74 SYK (0.38) XDH

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
US-8557805-B2 Fused ring compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-10-15 US disclosed
US-20120035163-A1 NOVEL FUSED RING COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED 2012-02-09 US disclosed
EP-2371826-A1 NOVEL FUSED RING COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2011-10-05 EP 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-20120035163-A1 NOVEL FUSED RING COMPOUND AND USE THEREOF GPR119, GCKR, SLC5A1 KMT2A 1470/4885XDH 859/4885LGALS8 1478/4885

“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.