SCHEMBL4297566

SCHEMBL4297566

CC(C)(C)[Si](C)(C)OCCn1ccc(NC(=O)C(Cc2ccccc2)n2ncc(Oc3c(F)cccc3F)cc2=O)n1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 9/20 0.36
RAB9A P51151 2/20 0.34
GCK P35557 2/20 0.33
MAPT P10636 3/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32
RAF1 P04049 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL4304773 0.93 GCK (0.33) GCK
SCHEMBL1078871 0.90 GCK (0.33) GCK
SCHEMBL1060470 0.89 HDAC8 (0.39) HDAC8RAB9AGCKMAPTNPC1
SCHEMBL4289059 0.88 HDAC8 (0.40) HDAC8RAB9AGCKMAPTNPC1
SCHEMBL1065503 0.87 GCK (0.42) GCK
SCHEMBL1063248 0.87 GCK (0.42) GCK
SCHEMBL1061850 0.86 GCK (0.42) GCK
SCHEMBL1080460 0.86 GCK (0.49) GCK
SCHEMBL4290688 0.81 STIM1 (0.35) RAB9AGCKMAPTNPC1SMN1; SMN2
SCHEMBL4295913 0.81 STIM1 (0.35) RAB9AGCKMAPTNPC1SMN1; SMN2

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 2 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
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 HDAC8 1783/4885RAB9A 3487/4885GCK 1/4885

“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.