SCHEMBL2447539

SCHEMBL2447539

CC(C)(C)OC(=O)N1CCC(=O)C(C(=O)CC2CCOCC2)C1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RECQL P46063 1/20 0.43
DDB1 Q16531 2/20 0.40
CRBN Q96SW2 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
USP30 Q70CQ3 1/20 0.39
NR1H2 P55055 1/20 0.38
GPR119 Q8TDV5 4/20 0.36
GLS O94925 2/20 0.36
KDM4E B2RXH2 2/20 0.36
THRB P10828 1/20 0.36
PKM P14618 1/20 0.35

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
SCHEMBL2842270 0.89 MAPT (0.44) DDB1CRBNMAPTMEN1ALDH1A1
SCHEMBL2448504 0.81 GRM5 (0.35)
SCHEMBL18815293 0.81 MAPT (0.42) USP2SMN1; SMN2DDB1CRBNMAPT
SCHEMBL8905844 0.80 BACE1 (0.48) DDB1CRBNMAPTMEN1ALDH1A1
SCHEMBL17868668 0.79 RECQL (0.43) USP2SMN1; SMN2RECQLDDB1CRBN
SCHEMBL19743146 0.78 ALDH1A1 (0.40) USP2SMN1; SMN2DDB1CRBNMAPT
SCHEMBL2843749 0.77 MAPT (0.41) USP2SMN1; SMN2RECQLDDB1CRBN
SCHEMBL5223609 0.77 USP2 (0.41) USP2SMN1; SMN2DDB1CRBNMAPT
SCHEMBL2123557 0.77 USP2 (0.41) USP2SMN1; SMN2RECQLDDB1CRBN
SCHEMBL17868619 0.77 MAPT (0.42) USP2SMN1; SMN2RECQLDDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
EP-2367826-A1 MODULATORS OF AMYLOID BETA. AstraZeneca AB (SE) 2011-09-28 EP disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 WO disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 WO 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-20100130495-A1 COMPOUNDS 563 BACE1, PSEN1, PSEN2 USP2 3826/4885SMN1; SMN2 318/4885RECQL 1021/4885

“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.