SCHEMBL1653505

SCHEMBL1653505

CCOC(=O)C(Cc1csc(-c2cc3cccc(N(C)S(=O)(=O)c4cccs4)c3[nH]2)n1)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 2/20 0.34
PKM P14618 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
PTGER2 P43116 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
LMNA P02545 4/20 0.33
RAB9A P51151 3/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 2/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL4521603 0.91 KDM4E (0.36) TSHRALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL12784632 0.89 ALDH1A1 (0.51) TSHRALDH1A1SMN1; SMN2NPSR1L3MBTL1
SCHEMBL1654169 0.85 KDM4E (0.41) TSHRALDH1A1SMN1; SMN2KDM4EPTGER2
SCHEMBL18568811 0.84 SMN1; SMN2 (0.34) TSHRALDH1A1SMN1; SMN2KDM4EPKM
SCHEMBL1654287 0.83 KDM4E (0.39) TSHRALDH1A1SMN1; SMN2KDM4EL3MBTL1
SCHEMBL1653484 0.83 KDM4E (0.36) TSHRALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL1654198 0.82 KDM4E (0.35) TSHRALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL13675258 0.82 KDM4E (0.37) TSHRALDH1A1SMN1; SMN2KDM4ECNR1
SCHEMBL1653569 0.82 ALDH1A1 (0.36) TSHRALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL1653391 0.80 RAB9A (0.32) TSHRALDH1A1SMN1; SMN2NPSR1L3MBTL1

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
EP-2308839-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICALS CO (JP) 2017-03-01 EP disclosed
US-8957070-B2 Glucokinase activator compounds, methods of activating glucokinase and methods of treating diabetes and obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-17 US disclosed
US-8957070-B2 Glucokinase activator compounds, methods of activating glucokinase and methods of treating diabetes and obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-17 US disclosed
EP-1873144-B1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL (JP) 2014-07-23 EP disclosed
EP-2308839-A1 Fused heterocyclic compounds Takeda Pharmaceutical Company Limited (JP) 2011-04-13 EP disclosed
EP-2308839-A1 Fused heterocyclic compounds Takeda Pharmaceutical Company Limited (JP) 2011-04-13 EP disclosed
US-20090247746-A1 Fused heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-01 US disclosed
EP-1873144-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-01-02 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-20090247746-A1 Fused heterocyclic compound GCKR, GCK, GPR119 TSHR 3701/4885ALDH1A1 372/4885SMN1; SMN2 4353/4885

“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.