SCHEMBL16654192

SCHEMBL16654192

CC(C)(C)OC(=O)N1CCN(c2ncc(-c3ccccc3)c(O)n2)CC1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.60
▸ SKP1 P63208 2/20 0.60
▸ SKP2 Q13309 2/20 0.60
▸ PTPN11 Q06124 1/20 0.58
▸ ACHE P22303 2/20 0.55
▸ GPR119 Q8TDV5 8/20 0.50
▸ GBA1 P04062 1/20 0.50
▸ KIT P10721 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ SMARCA2 P51531 1/20 0.47
▸ SMARCA4 P51532 1/20 0.47
▸ PBRM1 Q86U86 1/20 0.47
▸ BACE1 P56817 2/20 0.46

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
SCHEMBL16651683 0.82 ACHE (0.60) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL16651989 0.80 PTPN11 (0.53) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL3274585 0.80 ACHE (0.66) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL20818663 0.77 CKS1B (0.58) CKS1BSKP1SKP2ACHEGPR119
SCHEMBL16651654 0.77 PTPN11 (0.57) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL1447940 0.77 GPR119 (0.65) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL21551531 0.76 PTPN11 (0.53) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL29890873 0.76 PTPN11 (0.53) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL16654621 0.76 GPR119 (0.58) CKS1BSKP1SKP2PTPN11ACHE
SCHEMBL16653817 0.76 GPR119 (0.61) CKS1BSKP1SKP2PTPN11ACHE

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-2015058129-A1 COMPOSITIONS USEFUL FOR TREATING DISORDERS RELATED TO KIT BLUEPRINT MEDICINES CORPORATION (US) 2015-04-23 — — WO disclosed
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