SCHEMBL1064558

SCHEMBL1064558

CC(C)CC(C(=O)Nc1ccn(C[C@@H](O)CO)n1)n1ncc(Oc2ccccc2Cl)cc1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
XIAP P98170 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ATM Q13315 1/20 0.32
ALDH1A1 P00352 1/20 0.32
STAT3 P40763 1/20 0.32
CACNA1G O43497 1/20 0.31
CACNA1H O95180 1/20 0.31
CACNA1I Q9P0X4 1/20 0.31
GCK P35557 1/20 0.31
ABL1 P00519 1/20 0.31

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
SCHEMBL1063389 0.90 CACNA1G (0.32) CACNA1GCACNA1HCACNA1IGCKTYRO3
SCHEMBL1066984 0.90 PSMB5 (0.35) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL1062203 0.90 PSMB5 (0.35) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL1066259 0.90 PSMB5 (0.35) SMN1; SMN2LMNAMAPTKMT2AMEN1
SCHEMBL1064613 0.88 MAP2K1 (0.33) TYRO3
SCHEMBL1080884 0.87 XIAP (0.34) SMN1; SMN2LMNAMAPTXIAPNPSR1
SCHEMBL1063343 0.87 GCK (0.39) GCKABL1
SCHEMBL1063338 0.87 GCK (0.39) GCKABL1
SCHEMBL1063838 0.86 ADRB3 (0.32) LMNAKMT2AMEN1CYP1A2CYP3A4
SCHEMBL1065244 0.86 CASP1 (0.33) GCK

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-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
EP-2268633-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-05 EP disclosed
US-20090264434-A1 PYRIDAZINONE 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-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS GCK, GCKR, PDXK SMN1; SMN2 2837/4885LMNA 3588/4885MAPT 3782/4885

“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.