SCHEMBL18872255

SCHEMBL18872255

CC(C)(C)OCC(C)(C)N1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 5/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.30
PKM P14618 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
SCHEMBL8214792 0.83 ALDH1A1 (0.36) SMN1; SMN2USP2ALDH1A1GAAMEN1
SCHEMBL18775073 0.81 ALDH1A1 (0.36) SMN1; SMN2USP2ALDH1A1GAAMEN1
SCHEMBL1709046 0.80
SCHEMBL24182620 0.80 ALDH1A1 (0.35) SMN1; SMN2USP2ALDH1A1GAAMEN1
SCHEMBL18859426 0.78 CYP2B6 (0.32)
SCHEMBL16975531 0.73 MEN1 (0.42) ALDH1A1GAAMEN1KMT2AL3MBTL1
SCHEMBL16075552 0.73 MAPT (0.41) SMN1; SMN2USP2ALDH1A1KMT2AL3MBTL1
SCHEMBL9921756 0.73 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1GAAMEN1KMT2A
SCHEMBL17393082 0.73 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1GAAMEN1KMT2A
SCHEMBL23919087 0.72 USP2 (0.34) SMN1; SMN2USP2ALDH1A1GAAMEN1

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-20170137420-A1 PYRIDINO[1,2-A]PYRIMIDONE ANALOGUE USED AS P13K INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 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 (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-20170137420-A1 PYRIDINO[1,2-A]PYRIMIDONE ANALOGUE USED AS P13K INHIBITOR PIK3CA, PIK3CD, PIP5K1B SMN1; SMN2 2730/4885USP2 3459/4885ALDH1A1 1052/4885

“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.