SCHEMBL6515952

SCHEMBL6515952

O=C1C=NN(c2cccs2)C1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.31
NR1I2 O75469 1/20 0.31
PKM P14618 1/20 0.30

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
SCHEMBL7490265 0.64 CHRNA7 (0.31) CHRNA7NR1I2PKM
SCHEMBL8923397 0.64 MEN1 (0.33) PKM
SCHEMBL8658538 0.64 MAPT (0.43)
SCHEMBL21047585 0.63 NR1I2 (0.37) CHRNA7NR1I2PKM
SCHEMBL3969293 0.62 MAPT (0.31) CHRNA7
SCHEMBL8923639 0.62 NR1I2 (0.33) CHRNA7NR1I2
SCHEMBL3053970 0.62 GAA (0.42) PKM
SCHEMBL2048093 0.62
SCHEMBL21047744 0.62 NR1I2 (0.35) CHRNA7NR1I2PKM
SCHEMBL8373917 0.62 NISCH (0.33)

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-2005037839-A1 NORCANTHARIDIN DERIVATIVE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF ENTOMED (FR) 2005-04-28 WO disclosed