SCHEMBL20633705

SCHEMBL20633705

CCC1(CCNCCS)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
EPHX1 P07099 1/20 0.34
RORC P51449 2/20 0.34
NR1H2 P55055 1/20 0.33
EPHX2 P34913 2/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
RECQL P46063 1/20 0.32
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
GPR119 Q8TDV5 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
SCHEMBL24266959 0.80 USP2 (0.46) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL31735253 0.78 USP2 (0.37) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL18588199 0.75 NR1H2 (0.44) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL25273157 0.75 USP2 (0.39) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL17951421 0.74 USP2 (0.33) USP2SMN1; SMN2EPHX1NR1H2EPHX2
SCHEMBL31735300 0.73 USP2 (0.38) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL25270241 0.71 MEN1 (0.45) USP2SMN1; SMN2NR1H2GPR119
SCHEMBL24906857 0.70 NR1H2 (0.45) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL22022990 0.70 NR1H2 (0.47) USP2SMN1; SMN2EPHX1RORCNR1H2
SCHEMBL25224177 0.70 USP2 (0.37) USP2SMN1; SMN2RORCNR1H2GPR119

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
WO-2019009370-A1 AMIDE DERIVATIVE 大日本住友製薬株式会社 2019-01-10 WO disclosed