SCHEMBL1064772

SCHEMBL1064772

Cc1ccccc1OC1=CC(=O)N([C@@H](CC(C)C)C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 3/20 0.37
BCL2L2 Q92843 3/20 0.37
MME P08473 2/20 0.37
MCL1 Q07820 3/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
THRB P10828 1/20 0.34
LMNA P02545 1/20 0.34
ACE P12821 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FFAR1 O14842 1/20 0.33
PPARG P37231 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL1064773 1.00 BCL2 (0.37) BCL2BCL2L2MMEMCL1AKR1C3
SCHEMBL1063691 0.89 MME (0.33) BCL2BCL2L2MMEMCL1AKR1C3
SCHEMBL1063687 0.89 MME (0.33) BCL2BCL2L2MMEMCL1AKR1C3
SCHEMBL1064040 0.89 NPC1 (0.38) THRBLMNAKMT2AALDH1A1NPSR1
SCHEMBL2702971 0.89 NPC1 (0.38) THRBLMNAKMT2AALDH1A1NPSR1
SCHEMBL1066976 0.88 CXCL8 (0.40) BCL2BCL2L2MMEMCL1AKR1C3
SCHEMBL2656871 0.88 MME (0.38) BCL2BCL2L2MMEMCL1THRB
SCHEMBL1067056 0.88 MME (0.38) BCL2BCL2L2MMEMCL1THRB
SCHEMBL1069348 0.88 CXCL8 (0.40) BCL2BCL2L2MMEMCL1THRB
SCHEMBL2659036 0.88 CXCL8 (0.40) BCL2BCL2L2MMEMCL1AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 EP claimed
US-7741327-B2 Pyrrolidinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2010-06-22 US claimed
US-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US claimed
WO-2009127546-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-22 WO claimed
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 EP disclosed
EP-2274297-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-19 EP disclosed
US-7741327-B2 Pyrrolidinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2010-06-22 US disclosed
US-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
WO-2009127546-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-22 WO 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-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS GCKR, GCK, PDK2 BCL2 4430/4885BCL2L2 4320/4885MME 3517/4885

“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.