SCHEMBL2664258

SCHEMBL2664258

CC(=O)c1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(Oc2ccc(S(C)(=O)=O)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
HPGD P15428 1/20 0.53
RAB9A P51151 1/20 0.53
GCK P35557 13/20 0.49
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL12594254 0.94 MAPT (0.47) MAPTHPGDRAB9AGCKALDH1A1
SCHEMBL9891693 0.91 MEN1 (0.49) MAPTHPGDRAB9AGCKALDH1A1
SCHEMBL2664242 0.91 MAPT (0.47) MAPTHPGDRAB9AGCKALDH1A1
SCHEMBL10329791 0.90 GCK (0.60) GCK
SCHEMBL12742979 0.88 PTGS2 (0.46) MAPTHPGDRAB9AGCKALDH1A1
SCHEMBL10949996 0.88 MAPT (0.70) MAPTHPGDRAB9AALDH1A1SMN1; SMN2
SCHEMBL1139992 0.88 MEN1 (0.57) MAPTGCKSMN1; SMN2MEN1LMNA
SCHEMBL1107719 0.87 MEN1 (0.58) GCKALDH1A1POLBMEN1KMT2A
SCHEMBL12594271 0.87 GCK (0.53) GCK
SCHEMBL12742907 0.86 GCK (0.56) MAPTHPGDRAB9AGCKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 US disclosed
US-7910747-B2 Phosphonate and phosphinate pyrazolylamide glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-22 US disclosed
US-7812048-B2 Glucokinase activators and methods of using same BRISTOL-MYERS SQUIBB COMPANY (US) 2010-10-12 US disclosed
US-20090030046-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2009-01-29 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 MAPT 4710/4885HPGD 2924/4885RAB9A 1193/4885
US-20090030046-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, HK1 MAPT 4222/4885HPGD 3419/4885RAB9A 1180/4885

“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.