SCHEMBL28023308

SCHEMBL28023308

CCN(CC)C1CCN(OC(=O)C(C)(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.37
CBX7 O95931 2/20 0.34
CDYL2 Q8N8U2 2/20 0.34
CDYL Q9Y232 2/20 0.34
TRPV4 Q9HBA0 1/20 0.34
GPR119 Q8TDV5 5/20 0.32
CDY1; CDY1B Q9Y6F8 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL28124717 0.88 ACKR3 (0.31) ACKR3
SCHEMBL27735101 0.85 GPR119 (0.31) GPR119
SCHEMBL27987957 0.83 HTR2A (0.38) GPR119
SCHEMBL28007133 0.80 GPR119 (0.34) GPR119
SCHEMBL28267108 0.80 MCHR1 (0.37) TRPV4GPR119
SCHEMBL28253996 0.79 GPR119 (0.32) GPR119
SCHEMBL28291375 0.78 OPRK1 (0.34) ALDH1A1
SCHEMBL27679204 0.77 VNN1 (0.35)
SCHEMBL19652207 0.76 ACKR3 (0.41) ACKR3CBX7CDYL2CDYLTRPV4
SCHEMBL15410506 0.75 GPR119 (0.52) GPR119

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
CN-103459388-B Novel furanone derivative CARNA BIOSCIENCES, INC. (JP) 2015-11-25 CN disclosed
CN-104860891-A Arylaminopyrimidine compound and use thereof and pharmaceutical composition and medicinal composition prepared from arylaminopyrimidine compound SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO LTD 2015-08-26 CN disclosed