SCHEMBL28200552

SCHEMBL28200552

Cc1cc(C(=O)N2CCNCC2)ccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.54
PROKR1 Q8TCW9 2/20 0.52
HPGD P15428 2/20 0.50
MKNK1 Q9BUB5 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
TLR9 Q9NR96 1/20 0.47
TLR8 Q9NR97 1/20 0.47
TLR7 Q9NYK1 1/20 0.47
CCNC P24863 2/20 0.47
CDK8 P49336 2/20 0.47
RIPK1 Q13546 1/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL12294710 0.85 PROKR1 (0.63) PROKR1HPGDTLR9TLR8TLR7
SCHEMBL15445063 0.85 SIGMAR1 (0.64) SIGMAR1HPGDMKNK1MKNK2CCNC
SCHEMBL14872336 0.85 PROKR1 (0.63) PROKR1HPGD
SCHEMBL25335789 0.84 PROKR1 (0.56) PROKR1HPGDL3MBTL1HRH4
SCHEMBL25335781 0.84 PROKR1 (0.56) PROKR1HPGDL3MBTL1HRH4
SCHEMBL28266262 0.83 PROKR1 (0.53) PROKR1HPGDKDM4E
SCHEMBL7492026 0.81 SIGMAR1 (0.54) SIGMAR1PROKR1HPGDMKNK1MKNK2
SCHEMBL17689077 0.81 HPGD (0.60) PROKR1HPGDKDM4EL3MBTL1
SCHEMBL22601444 0.81 LMNA (0.66) SIGMAR1HPGDMKNK1MKNK2CCNC
SCHEMBL21212583 0.80 PROKR1 (0.57) PROKR1HPGD

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-107721943-A Jie Gou oxazolidinone compounds of hydrazone containing biaryl and preparation method thereof 沈阳药科大学 2018-02-23 CN disclosed