SCHEMBL1064353

SCHEMBL1064353

COCCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 1/20 0.49
TP53 P04637 1/20 0.49
CASP3 P42574 1/20 0.49
KMT2A Q03164 1/20 0.49
MDM2 Q00987 2/20 0.48
TLR2 O60603 3/20 0.47
EPHX2 P34913 1/20 0.46

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
SCHEMBL1064352 1.00 MDM4 (0.49) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29462653 0.92 MDM2 (0.56) MDM4TP53CASP3MDM2TLR2
SCHEMBL524544 0.92 MDM2 (0.56) MDM4TP53CASP3MDM2TLR2
SCHEMBL30670316 0.92 MDM2 (0.56) MDM4TP53CASP3MDM2TLR2
SCHEMBL621563 0.92 MDM2 (0.56) MDM4TP53CASP3MDM2TLR2
SCHEMBL29462655 0.92 MDM2 (0.56) MDM4TP53CASP3MDM2TLR2
SCHEMBL27401805 0.90 KMT2A (0.51) MDM4TP53CASP3KMT2ATLR2
SCHEMBL8138543 0.90 KMT2A (0.51) MDM4TP53CASP3KMT2ATLR2
SCHEMBL377523 0.89 MDM4 (0.50) MDM4TP53CASP3KMT2AMDM2
SCHEMBL1784562 0.89 TLR2 (0.50) MDM4TP53CASP3KMT2AMDM2

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 5 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 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 MDM4 4738/4885TP53 4199/4885CASP3 3760/4885

“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.