SCHEMBL7566142

SCHEMBL7566142

O=C1NOC[C@@H]1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.51
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
HDAC8 Q9BY41 2/20 0.42
GRM2 Q14416 1/20 0.41
CA2 P00918 1/20 0.39
HSD11B1 P28845 1/20 0.39
BLM P54132 2/20 0.38
MEN1 O00255 1/20 0.38
GRIN2D O15399 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
PTGS1 P23219 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38

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
SCHEMBL19540607 0.72 MAOB (0.60) MAOBDDB1CRBN
SCHEMBL29173299 0.72 MAOB (0.60) MAOBDDB1CRBN
SCHEMBL1226583 0.70 HDAC8 (0.56) MAOBDDB1CRBNHDAC8CA2
SCHEMBL10283637 0.70 HDAC8 (0.56) MAOBDDB1CRBNHDAC8CA2
SCHEMBL29013938 0.70 DDB1 (0.52) MAOBDDB1CRBNHDAC8HSD11B1
SCHEMBL13399577 0.70 HDAC8 (0.56) MAOBDDB1CRBNHDAC8CA2
SCHEMBL1405670 0.70 HDAC8 (0.56) MAOBDDB1CRBNHDAC8CA2
SCHEMBL18751777 0.70 HDAC8 (0.56) MAOBDDB1CRBNHDAC8CA2
SCHEMBL837901 0.69 DDB1 (0.60) MAOBDDB1CRBNHDAC8HSD11B1
SCHEMBL6565739 0.69 DDB1 (0.51) MAOBDDB1CRBNHDAC8CA2

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
US-20020045679-A1 Aqueous ink composition HITACHI MAXELL, LTD. (JP) 2002-04-18 US disclosed