SCHEMBL9892883

SCHEMBL9892883

CC(=O)/C(=C/C1CCCC1)c1ccc(S(C)(=O)=O)c(I)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.39
KMT2A Q03164 3/20 0.34
THRB P10828 4/20 0.32
MEN1 O00255 2/20 0.32
PPARG P37231 2/20 0.32
POLB P06746 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM2B Q8NHM5 1/20 0.32
SLC9A1 P19634 1/20 0.31
VDR P11473 1/20 0.31
ALDH1A1 P00352 1/20 0.31
VCAM1 P19320 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL10205368 0.88 GCK (0.37) GCKKMT2ATHRB
SCHEMBL2669024 0.85 GCK (0.53) GCKKMT2AMEN1
SCHEMBL2669023 0.78 KMT2A (0.51) GCKKMT2A
SCHEMBL1171734 0.76 GCK (0.52) GCK
SCHEMBL1171737 0.76 GCK (0.52) GCK
SCHEMBL2645973 0.76 GCK (0.38) GCKKMT2AKDM2B
SCHEMBL2645977 0.76 GCK (0.38) GCKKMT2AKDM2B
SCHEMBL1171343 0.75 GCK (0.51) GCK
SCHEMBL1171340 0.75 GCK (0.51) GCK
SCHEMBL1171342 0.74 GCK (0.50) GCKKMT2ATHRBMEN1PPARG

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-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2012-06-07 US disclosed
US-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 US disclosed
US-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 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 (2 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-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, MPO, GCK GCK 3/4885KMT2A 2216/4885THRB 1307/4885
US-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 GCK 2/4885KMT2A 2260/4885THRB 887/4885

“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.