SCHEMBL22907259

SCHEMBL22907259

COC(=O)c1nc(N2CCN(C(=O)OC(C)(C)C)CC2)ccc1C

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.53
CKS1B P61024 2/20 0.49
SKP1 P63208 2/20 0.49
SKP2 Q13309 2/20 0.49
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
NR1H2 P55055 1/20 0.46
GPR119 Q8TDV5 6/20 0.45
ACHE P22303 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SUV39H2 Q9H5I1 1/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RET P07949 1/20 0.43
KIT P10721 1/20 0.42

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
SCHEMBL22907253 0.88 MAP4K4 (0.53) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL12328836 0.83 MAP4K4 (0.57) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL30686573 0.82 MAP4K4 (0.37) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL20046669 0.82 CKS1B (0.58) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL2448474 0.81 MAP4K4 (0.56) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL31130022 0.81 MAP4K4 (0.65) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL31129803 0.80 ALDH1A1 (0.57) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL20163032 0.80 CKS1B (0.56) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL3186820 0.80 CKS1B (0.56) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL16333807 0.80 MAP4K4 (0.52) MAP4K4CKS1BSKP1SKP2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021011913-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2021-01-21 WO disclosed