SCHEMBL2700614

SCHEMBL2700614

COC(=O)C(CC(C)C)N1CC(Oc2cccc(OC)c2Cl)=CC1=O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 1/20 0.35
ANPEP P15144 1/20 0.34
P2RX7 Q99572 2/20 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
SCHEMBL1068248 1.00 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL2700983 0.92 CARM1 (0.37) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL1068377 0.92 CARM1 (0.37) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL1069541 0.91 ALDH1A1 (0.40) ALDH1A1LMNAMAPT
SCHEMBL2703301 0.91 ALDH1A1 (0.40) ALDH1A1LMNAMAPT
SCHEMBL1067287 0.91 FDFT1 (0.35) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL1067285 0.91 FDFT1 (0.35) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL2700348 0.88 GNRHR (0.35) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL1066291 0.88 GNRHR (0.35) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL2700658 0.88 NPSR1 (0.38) ALDH1A1SMN1; SMN2NPSR1MAPTANPEP

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
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 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

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 ALDH1A1 1129/4885SMN1; SMN2 2392/4885LMNA 3936/4885

“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.