SCHEMBL7216147

SCHEMBL7216147

CC1NC(C)(C(C)C)C(=O)O1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.32
PSMB11 A5LHX3 1/20 0.32
PSMA7 O14818 1/20 0.32
PSMB1 P20618 1/20 0.32
PSMA1 P25786 1/20 0.32
PSMA2 P25787 1/20 0.32
PSMA3 P25788 1/20 0.32
PSMA4 P25789 1/20 0.32
PSMB8 P28062 1/20 0.32
PSMB9 P28065 1/20 0.32
PSMA5 P28066 1/20 0.32
PSMB4 P28070 1/20 0.32
PSMB6 P28072 1/20 0.32
PSMB10 P40306 1/20 0.32
PSMB3 P49720 1/20 0.32
PSMB2 P49721 1/20 0.32
PSMA6 P60900 1/20 0.32
PSMA8 Q8TAA3 1/20 0.32
PSMB7 Q99436 1/20 0.32

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
SCHEMBL6112974 0.72
SCHEMBL7214177 0.71 CA2 (0.41)
SCHEMBL7219129 0.67 SMN1; SMN2 (0.35)
SCHEMBL7214035 0.67 SLC6A2 (0.35)
SCHEMBL6113138 0.62 TSHR (0.30)
SCHEMBL15281483 0.56
SCHEMBL3825916 0.56 MAPT (0.31)
SCHEMBL576391 0.56
SCHEMBL13637170 0.55
SCHEMBL24796620 0.54 PTPN1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6504046-B1 Cyclization of nitriles using acids, to form oxazolinone chemical intermediates such as 2-phenyl-4-isopropyl-4-methyl-1,3-oxazol-5-one, used as fungicides IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2003-01-07 US disclosed
EP-1092705-A1 PROCESS FOR THE PREPARATION OF AMIDES IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2001-04-18 EP disclosed