SCHEMBL20142785

SCHEMBL20142785

Cn1ccc2cccc(N3CCN(C(=O)OC(C)(C)C)CC3)c21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.46
SKP1 P63208 2/20 0.46
SKP2 Q13309 2/20 0.46
BACE1 P56817 4/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
GPR119 Q8TDV5 2/20 0.43
SMARCA2 P51531 1/20 0.43
SMARCA4 P51532 1/20 0.43
PBRM1 Q86U86 1/20 0.43
ACHE P22303 2/20 0.43
NAMPT P43490 1/20 0.42
MAP4K4 O95819 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL6584762 0.88 CKS1B (0.46) CKS1BSKP1SKP2BACE1ALDH1A1
SCHEMBL20142485 0.80 MAPT (0.49) ALDH1A1MAPTLMNAPOLB
SCHEMBL4863963 0.80 CHRM2 (0.48) CKS1BSKP1SKP2BACE1ALDH1A1
SCHEMBL5202415 0.80 HTR6 (0.52) CKS1BSKP1SKP2BACE1GPR119
SCHEMBL26099409 0.80 GPR119 (0.46) MAPTGPR119NAMPTPOLB
SCHEMBL4558301 0.79 BACE1 (0.59) CKS1BSKP1SKP2BACE1ALDH1A1
SCHEMBL6588562 0.78 BACE1 (0.46) CKS1BSKP1SKP2BACE1ALDH1A1
SCHEMBL26842219 0.78 BACE1 (0.44) CKS1BSKP1SKP2BACE1ALDH1A1
SCHEMBL5366552 0.77 TP53 (0.49) CKS1BSKP1SKP2BACE1ALDH1A1
SCHEMBL14395343 0.76 DRD2 (0.49) ALDH1A1MAPTLMNA

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