SCHEMBL28276124

SCHEMBL28276124

CC1CC(C(=O)N2CCOCC2)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 1/20 0.38
DPP4 P27487 2/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 2/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 4/20 0.37
HTT P42858 1/20 0.37
POLB P06746 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RECQL P46063 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL25111585 0.71 DPP4 (0.48) SMN1; SMN2TSHRDPP4KDM4ELMNA
SCHEMBL597171 0.71 NAMPT (0.46) SMN1; SMN2TSHRMAPTPOLB
SCHEMBL597029 0.71 NAMPT (0.46) SMN1; SMN2TSHRMAPTPOLB
SCHEMBL3633044 0.71 MAPT (0.39) SMN1; SMN2TSHRMAPTALDH1A1HTT
SCHEMBL597028 0.71 NAMPT (0.46) SMN1; SMN2TSHRMAPTPOLB
SCHEMBL935614 0.70 CAD (0.43) TSHRLMNARAB9AHTT
SCHEMBL935613 0.70 CAD (0.43) TSHRLMNARAB9AHTT
SCHEMBL28926783 0.70 CAD (0.43) TSHRLMNARAB9AHTT
SCHEMBL13445004 0.69 CHRNB2 (0.50) SMN1; SMN2TSHRKDM4ELMNARAB9A
SCHEMBL30701613 0.68 DPP4 (0.42) SMN1; SMN2TSHRDPP4ALDH1A1HTT

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
CN-109384701-A It is a kind of to be used to prepare compound and the preparation method and application thereof of the Sha Ku than song 上海朴颐化学科技有限公司 2019-02-26 CN disclosed