SCHEMBL7020336

SCHEMBL7020336

CC(C)(C)OC(=O)N[C@H](CO)Cc1ccccc1C(=S)NC1CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.42
▸ KDM1A O60341 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ DRD2 P14416 2/20 0.39
▸ CACNA1B Q00975 1/20 0.38
▸ CTSS P25774 3/20 0.37
▸ CTSK P43235 3/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ SCN9A Q15858 2/20 0.37
▸ KCNA3 P22001 1/20 0.36
▸ GAA P10253 1/20 0.36

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 0.85 ATM (0.46) ATMCTSSCTSK
SCHEMBL7020848 0.84 ATM (0.45) ATMCTSSCTSKKMT2A
SCHEMBL7016941 0.83 ATM (0.46) ATMCTSSCTSK
SCHEMBL7018122 0.83 ATM (0.46) ATMCTSSCTSK
SCHEMBL7018564 0.81 ATM (0.42) ATMCTSSCTSKSCN9A
SCHEMBL7464875 0.81 ATM (0.47) ATMCTSSCTSK
SCHEMBL7464877 0.81 ATM (0.47) ATMCTSSCTSK
SCHEMBL7024422 0.79 ATM (0.39) ATMCTSSCTSKL3MBTL1
SCHEMBL7021557 0.78 PTPN1 (0.44) ATMCTSK
SCHEMBL7021561 0.78 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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