SCHEMBL15445151

SCHEMBL15445151

Cn1cc(COCCO)nn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.36
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
IDO1 P14902 1/20 0.33
IDO2 Q6ZQW0 1/20 0.33
DGAT1 O75907 4/20 0.33
HSP90AB1 P08238 4/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BRD4 O60885 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 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
SCHEMBL2628198 0.86 MMP2 (0.37) P2RX7DDB1CRBNHSP90AB1MAOA
SCHEMBL13872398 0.85 HSP90AB1 (0.41) P2RX7DDB1CRBNHSP90AB1MAOA
SCHEMBL28025119 0.82 DGAT1 (0.42) P2RX7DDB1CRBNDGAT1HSP90AB1
SCHEMBL21424270 0.81 P2RX7 (0.40) P2RX7DDB1CRBNDGAT1HSP90AB1
SCHEMBL20806028 0.79 P2RX7 (0.53) P2RX7DDB1CRBNHSP90AB1MAOA
SCHEMBL20257915 0.79 HSP90AB1 (0.40) P2RX7IDO1IDO2DGAT1HSP90AB1
SCHEMBL19153067 0.79 P2RX7 (0.34) P2RX7DDB1CRBNDGAT1
SCHEMBL10067691 0.77
SCHEMBL24075828 0.77 DGAT1 (0.37) P2RX7DDB1CRBNDGAT1HSP90AB1
SCHEMBL28025149 0.77 DGAT1 (0.42) P2RX7DDB1CRBNDGAT1HSP90AB1

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
EP-2690105-A1 Mannose derivatives, a process for preparing the same and their uses as a drug Centre National De La Recherche Scientifique (FR) 2014-01-29 EP disclosed