SCHEMBL20140758

SCHEMBL20140758

Cc1cccc(N2CCCN(C(=O)OC(C)(C)C)CC2)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.60
SKP1 P63208 2/20 0.60
SKP2 Q13309 2/20 0.60
MAP4K4 O95819 1/20 0.51
PDE10A Q9Y233 1/20 0.50
GRM5 P41594 1/20 0.50
TGM2 P21980 2/20 0.49
GPR119 Q8TDV5 4/20 0.49
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49
HTR3A P46098 1/20 0.49
HTR3D Q70Z44 1/20 0.49
HTR3C Q8WXA8 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TRPA1 O75762 1/20 0.45
MAPT P10636 3/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL4524210 0.95 CKS1B (0.57) CKS1BSKP1SKP2MAP4K4GRM5
SCHEMBL461584 0.87 CKS1B (0.62) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL1481924 0.87 CKS1B (0.59) CKS1BSKP1SKP2MAP4K4PDE10A
SCHEMBL23104148 0.87 CKS1B (0.59) CKS1BSKP1SKP2MAP4K4PDE10A
SCHEMBL20142337 0.87 CKS1B (0.59) CKS1BSKP1SKP2MAP4K4PDE10A
SCHEMBL4298159 0.86 CKS1B (0.64) CKS1BSKP1SKP2MAP4K4PDE10A
SCHEMBL1532924 0.82 GPR119 (0.57) GRM5TGM2GPR119
SCHEMBL29664252 0.82 CKS1B (0.57) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL461585 0.82 CKS1B (0.60) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL4949224 0.82 CKS1B (0.57) CKS1BSKP1SKP2MAP4K4GPR119

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
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed