SCHEMBL9257243

SCHEMBL9257243

CC(C)OCC1CC(=O)N(C(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.37
POLB P06746 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 2/20 0.33
BRD4 O60885 2/20 0.33
HSD17B10 Q99714 1/20 0.33
PGR P06401 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 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
SCHEMBL20667182 0.81 BRD4 (0.55) KMT2ABRD4CYP3A4CYP2C19
SCHEMBL12424234 0.78 MAPT (0.52) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL18543269 0.77 MAPT (0.50) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL11534030 0.77 BRD4 (0.58) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL9259167 0.77 MAPT (0.50) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL9259617 0.75 MAPT (0.49) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL10491077 0.75 MAPT (0.49) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL9259267 0.72 MAPT (0.46) MAPTLMNAPOLBSMN1; SMN2L3MBTL1
SCHEMBL11609520 0.71 MAPT (0.36) MAPTLMNAPOLBSMN1; SMN2KMT2A
SCHEMBL9252750 0.71 MAPT (0.45) MAPTLMNAPOLBSMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135997-A1 PHARMACEUTICAL COMPOSITION COMPRISING A LACTAM OR BENZENESULFONAMIDE COMPOUND SHIONOGI & CO., LTD. (JP) 2012-05-31 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-20120135997-A1 PHARMACEUTICAL COMPOSITION COMPRISING A LACTAM OR BENZENESULFONAMIDE COMPOUND BACE1, STS, APP MAPT 53/4885LMNA 3777/4885POLB 3116/4885

“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.