SCHEMBL16701535

SCHEMBL16701535

CC1(C)OC(=O)C(C(=O)C2CCN(C(C)(C)C)CC2)C(=O)O1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.37
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.33
GSK3B P49841 1/20 0.31
DYRK1A Q13627 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL7993286 0.82 BACE1 (0.41) BACE1MAPTSMN1; SMN2GAA
SCHEMBL16197279 0.81 MAPT (0.37) BACE1MAPTSMN1; SMN2GAAALDH1A1
SCHEMBL9939055 0.80 RECQL (0.50) MAPTSMN1; SMN2
SCHEMBL1403152 0.79 BACE1 (0.40) BACE1MAPTSMN1; SMN2GAAALDH1A1
SCHEMBL1403176 0.79 BACE1 (0.40) BACE1MAPTSMN1; SMN2GAA
SCHEMBL7992161 0.78 BACE1 (0.39) BACE1MAPTSMN1; SMN2GAAALDH1A1
SCHEMBL695478 0.76 BACE1 (0.38) BACE1
SCHEMBL16701732 0.75 GABRA1 (0.38) BACE1
SCHEMBL14698626 0.75 MAPT (0.32) BACE1MAPTSMN1; SMN2
SCHEMBL15141075 0.73 LMNA (0.36) MAPTSMN1; SMN2GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3215505-A1 PIPERIDINYLPYRAZOLOPYRIMIDINONES AND THEIR USE Bayer Pharma Aktiengesellschaft (DE) 2017-09-13 EP disclosed
EP-3066100-A1 (AZA)PYRIDOPYRAZOLOPYRIMIDINONES AND INDAZOLOPYRIMIDINONES AS INHIBITORS OF FIBRINOLYSIS Bayer Pharma Aktiengesellschaft (DE) 2016-09-14 EP disclosed
WO-2016071216-A1 PIPERIDINYLPYRAZOLOPYRIMIDINONES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-12 WO disclosed
WO-2015067549-A1 (AZA)PYRIDOPYRAZOLOPYRIMIDINONES AND INDAZOLOPYRIMIDINONES AS INHIBITORS OF FIBRINOLYSIS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-14 WO disclosed