SCHEMBL20748967

SCHEMBL20748967

CCOC(=O)c1c(C)nn2c1CB(C#N)C(C1CC1)C2

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.33
PLAT P00750 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.32
PDE4B Q07343 1/20 0.31
MAPK1 P28482 1/20 0.31
SLC34A1 Q06495 3/20 0.31
P2RY12 Q9H244 1/20 0.30
MAPT P10636 1/20 0.30
NMT2 O60551 1/20 0.30
NMT1 P30419 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
SCHEMBL20748867 0.85 PDE4D (0.35) PDE4DPLATALDH1A1KDM4EHSD17B10
SCHEMBL20748977 0.85
SCHEMBL20748869 0.84
SCHEMBL20748908 0.82 PDE4D (0.33) PDE4DPLATALDH1A1KDM4EHSD17B10
SCHEMBL20748874 0.74 PDE4D (0.36) PDE4DALDH1A1KDM4EHSD17B10HPGD
SCHEMBL20748999 0.71 PDE4D (0.38) PDE4DPLATALDH1A1KDM4EHPGD
SCHEMBL20748864 0.69 POLB (0.30) POLB
SCHEMBL20748906 0.67 PDE4D (0.40) PDE4DPLATALDH1A1KDM4EHPGD
SCHEMBL20748887 0.66
SCHEMBL20749015 0.65

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-3068785-B1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-06-26 EP disclosed
EP-3068784-B1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-02-20 EP disclosed