SCHEMBL3669512

SCHEMBL3669512

CC(C)(C)OC(=O)N1CCN(c2nccnc2-c2ccccc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.66
SKP1 P63208 2/20 0.66
SKP2 Q13309 2/20 0.66
KIT P10721 2/20 0.59
GBA1 P04062 2/20 0.57
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ACHE P22303 1/20 0.52
GRIA1 P42261 1/20 0.52
PDE10A Q9Y233 1/20 0.51
GPR119 Q8TDV5 4/20 0.50
POLB P06746 1/20 0.49
PTPN11 Q06124 1/20 0.47
PIK3CA P42336 1/20 0.47

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
SCHEMBL2332808 0.88 GRIA1 (0.65) CKS1BSKP1SKP2KITGBA1
SCHEMBL3667084 0.88 MEN1 (0.53) CKS1BSKP1SKP2KITGBA1
SCHEMBL3667078 0.87 CKS1B (0.52) CKS1BSKP1SKP2KITGBA1
SCHEMBL3674036 0.87 CKS1B (0.52) CKS1BSKP1SKP2KITGBA1
SCHEMBL9961630 0.86 CKS1B (0.65) CKS1BSKP1SKP2KITGBA1
SCHEMBL30591902 0.86 GRIA1 (0.53) CKS1BSKP1SKP2KITMEN1
SCHEMBL3320806 0.86 GRIA1 (0.51) CKS1BSKP1SKP2KITGBA1
SCHEMBL26105834 0.86 GRIA1 (0.53) CKS1BSKP1SKP2KITMEN1
SCHEMBL3673302 0.85 TRPV1 (0.52) CKS1BSKP1SKP2KITGBA1
SCHEMBL3665781 0.85 EGLN2 (0.57) CKS1BSKP1SKP2KITGRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202873-B2 2-[4-(pyrazol-4-ylalkyl)piperazin-1-yl]-3-phenyl pyrazines as 5-HT7 receptor antagonists ELI LILLY AND COMPANY (US) 2012-06-19 US disclosed
EP-2155717-A1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-02-24 EP disclosed
WO-2008141020-A1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2008-11-20 WO disclosed