SCHEMBL7024422

SCHEMBL7024422

CC(C)(C)OC(=O)N[C@H](CO)Cc1ccccc1C(=S)NN1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.39
▸ LIPE Q05469 2/20 0.38
▸ CD274 Q9NZQ7 1/20 0.35
▸ CTSK P43235 4/20 0.35
▸ CTSS P25774 4/20 0.35
▸ KCNA5 P22460 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC10 Q969S8 1/20 0.34
▸ HDAC11 Q96DB2 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC9 Q9UKV0 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7026299 0.81 ATM (0.46) ATMCTSKCTSSKCNA5HDAC3
SCHEMBL7020848 0.80 ATM (0.45) ATMCTSKCTSSKCNA5
SCHEMBL7016941 0.79 ATM (0.46) ATMCTSKCTSSKCNA5HDAC3
SCHEMBL7018122 0.79 ATM (0.46) ATMCTSKCTSSKCNA5HDAC3
SCHEMBL7020336 0.79 ATM (0.42) ATMCTSKCTSSL3MBTL1
SCHEMBL7018564 0.77 ATM (0.42) ATMCTSKCTSSKCNA5
SCHEMBL7464877 0.77 ATM (0.47) ATMCTSKCTSSKCNA5HDAC3
SCHEMBL7464875 0.77 ATM (0.47) ATMCTSKCTSSKCNA5HDAC3
SCHEMBL7775449 0.75 LIPE (0.47) LIPECTSKCTSSALDH1A1SMN1; SMN2
SCHEMBL7021557 0.74 PTPN1 (0.44) ATMCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1149076-B1 O-THIOCARBAMOYL-AMINOALKANOL COMPOUNDS, THEIR PHARMACEUTICALLY ACCEPTABLE SALTS AND PROCESS FOR PREPARING THE SAME SK CORP (KR) 2003-10-22 — — EP disclosed
EP-1149076-A1 O-THIOCARBAMOYL-AMINOALKANOL COMPOUNDS, THEIR PHARMACEUTICALLY ACCEPTABLE SALTS AND PROCESS FOR PREPARING THE SAME SK Corporation (KR) 2001-10-31 — — EP disclosed
WO-2000046191-A1 O-THIOCARBAMOYL-AMINOALKANOL COMPOUNDS, THEIR PHARMACEUTICALLY ACCEPTABLE SALTS AND PROCESS FOR PREPARING THE SAME SK CORPORATION (KR) 2000-08-10 — — WO disclosed
US-5935997-A O-thiocarbamoyl-aminoalkanol compounds, their pharmaceutically useful salts and process for preparing the same YUKONG LIMITED (KR) 1999-08-10 — — US disclosed
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