SCHEMBL7776531

SCHEMBL7776531

CC(C)(C)[Si](C)(C)[C@]1(n2ccc(N)nc2=O)C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 3/20 0.43
PDE4D Q08499 1/20 0.43
SLC29A1 Q99808 1/20 0.43
LMNA P02545 4/20 0.42
THRB P10828 1/20 0.42
MTOR P42345 1/20 0.42
MDM2 Q00987 1/20 0.42
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
CACNA1F O60840 2/20 0.36
ALB P02768 2/20 0.36
MAPT P10636 2/20 0.36
CACNA1D Q01668 2/20 0.36
CACNA1S Q13698 2/20 0.36
CACNA1C Q13936 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ADRB1 P08588 1/20 0.32
DNMT1 P26358 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
SCHEMBL28845396 0.87 PDE3A (0.39) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL30164300 0.82 PDE3A (0.41) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL30241285 0.81 ALB (0.39) PDE3APDE4DSLC29A1ALBADRB1
SCHEMBL7794942 0.81 PDE3A (0.46) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL992472 0.81 PDE3A (0.46) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL8932752 0.81 PDE3A (0.44) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL2118776 0.80 PDE3A (0.46) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL1939478 0.80 PDE3A (0.47) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL3424602 0.80 PDE3A (0.47) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL28379714 0.80 PDE3A (0.47) PDE3APDE4DSLC29A1LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0423839-B1 Polynucleotides and probes useful in solution phase nucleic acid sandwich assay BAYER AG (US) 2001-08-16 EP disclosed
EP-0225807-B1 Solution phase nucleic acid sandwich assay and polynucleotide probes useful therein CHIRON CORP (US) 1994-10-19 EP disclosed