SCHEMBL18865417

SCHEMBL18865417

CC(C)C(C)NC1CCC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ATM Q13315 1/20 0.31
DPP4 P27487 1/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH7 P40394 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL18613034 0.92 GAA (0.42) GAAL3MBTL1ALDH1A1SMN1; SMN2ATM
SCHEMBL11051416 0.92 GAA (0.42) GAAL3MBTL1ALDH1A1SMN1; SMN2ATM
SCHEMBL24225594 0.92 GAA (0.42) GAAL3MBTL1ALDH1A1SMN1; SMN2ATM
SCHEMBL13242284 0.88
SCHEMBL21799493 0.80 KDM1A (0.36)
SCHEMBL18684792 0.79 GAA (0.43) GAAL3MBTL1ALDH1A1SMN1; SMN2ATM
SCHEMBL104716 0.79
SCHEMBL25086282 0.77 MAPK1 (0.33)
SCHEMBL21800038 0.77 SMYD3 (0.37)
SCHEMBL24368315 0.77 ROCK2 (0.32)

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-3995517-A1 AMIDE COMPOUND, POLYMERIZABLE COMPOSITION, CURED PRODUCT, AND PRODUCTION METHOD THEREOF ADEKA CORPORATION (JP) 2022-05-11 EP disclosed
US-10005767-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2018-06-26 US disclosed
US-20170137411-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2017-05-18 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 (2 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-20170137411-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 GAA 2139/4885L3MBTL1 3539/4885ALDH1A1 3988/4885
US-10005767-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 GAA 2139/4885L3MBTL1 3539/4885ALDH1A1 3988/4885

“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.