SCHEMBL8499104

SCHEMBL8499104

c1ccc(CN(Cc2ccccc2)N=C2CCc3ccccc3C2)cc1.c1ccc(N(N=C2CCc3ccccc3C2)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
G6PC1 P35575 9/20 0.45
GRIN2B Q13224 2/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
CYP2D6 P10635 1/20 0.31
PDE6A P16499 1/20 0.31
ADRA2C P18825 1/20 0.31
MC4R P32245 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31
MC3R P41968 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KMT2A Q03164 1/20 0.31
PDE4D Q08499 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
SCHEMBL8498267 0.91 G6PC1 (0.51) G6PC1GRIN2BTSHRCYP2A6
SCHEMBL8493516 0.87 CYP2A6 (0.39) TSHRCYP1A2DRD3KMT2ACYP2A6
SCHEMBL8498371 0.81 LRRK2 (0.42) G6PC1GRIN2BTSHRLMNAKMT2A
SCHEMBL14799680 0.77 G6PC1 (0.53) G6PC1TSHR
SCHEMBL14799400 0.73 G6PC1 (0.51) G6PC1TSHR
SCHEMBL14799399 0.73 G6PC1 (0.51) G6PC1TSHR
SCHEMBL8499655 0.73 GAA (0.35) G6PC1LMNAKMT2ALRRK2POLB
SCHEMBL8498988 0.70 G6PC1 (0.84) G6PC1LMNAKMT2ACYP2A6LRRK2
SCHEMBL8498991 0.70 G6PC1 (0.84) G6PC1LMNAKMT2ACYP2A6LRRK2
SCHEMBL15439235 0.69 G6PC1 (0.46) G6PC1TSHR

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-1999040062-A1 HYDRAZONE DERIVATIVES NOVO NORDISK A/S (DK) 1999-08-12 WO claimed