SCHEMBL11210322

SCHEMBL11210322

C=CCc1ccccc1COc1ccc2[nH]c3c(C)c4ccncc4c(C)c3c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 5/20 0.60
RECQL P46063 3/20 0.60
KDM4E B2RXH2 2/20 0.60
MEN1 O00255 2/20 0.60
NR3C1 P04150 2/20 0.60
POLB P06746 2/20 0.60
MAPT P10636 2/20 0.60
RAB9A P51151 2/20 0.60
KMT2A Q03164 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
TLR3 O15455 1/20 0.60
PKM P14618 1/20 0.60
PDGFRA P16234 2/20 0.54
FGFR3 P22607 2/20 0.54
TDP1 Q9NUW8 2/20 0.53
NPC1 O15118 1/20 0.53
GMNN O75496 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
TP53 P04637 1/20 0.53

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
SCHEMBL11160990 0.83 KIT (0.69) KITRECQLKDM4EMEN1NR3C1
SCHEMBL31362095 0.83 KIT (0.69) KITRECQLKDM4EMEN1NR3C1
SCHEMBL11218842 0.83 KIT (0.56) KITRECQLKDM4EMEN1NR3C1
SCHEMBL5309123 0.80 KDM4E (0.76) KITRECQLKDM4EMEN1NR3C1
SCHEMBL11866502 0.78 KIT (0.70) KITRECQLKDM4EMEN1NR3C1
SCHEMBL26836186 0.78 KIT (0.73) KITRECQLKDM4EMEN1NR3C1
SCHEMBL1005968 0.76 KIT (1.00) KITRECQLKDM4EMEN1NR3C1
SCHEMBL5294321 0.75 KIT (0.69) KITRECQLKDM4EMEN1NR3C1
SCHEMBL11831488 0.75 KIT (0.74) KITRECQLKDM4EMEN1NR3C1
SCHEMBL9439101 0.74 KIT (0.64) KITRECQLKDM4EMEN1NR3C1

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-0009445-B1 PROCESS FOR THE PREPARATION OF 9-HYDROXY-ELLIPTICINE AND DERIVATIVES THEREOF ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1983-05-18 EP claimed