SCHEMBL11245206

SCHEMBL11245206

Clc1nc(NCCCOc2ccccc2)c2ccccc2n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.62
GBA1 P04062 6/20 0.60
PDE5A O76074 1/20 0.57
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
PIK3CD O00329 1/20 0.50
PIK3R1 P27986 1/20 0.50
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
ACP1 P24666 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46

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
SCHEMBL11250201 0.96 APP (0.63) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11254689 0.93 MEN1 (0.59) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11250518 0.88 DRD2 (0.53) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11251275 0.87 GBA1 (0.63) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11244506 0.86 APP (0.54) APPGBA1PDE5AMEN1KMT2A
SCHEMBL23723479 0.86 KMT2A (0.70) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11245481 0.84 APP (0.53) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11243968 0.84 GBA1 (0.70) APPGBA1PDE5AMEN1KMT2A
SCHEMBL11260828 0.83 GBA1 (0.60) GBA1PDE5AMEN1KMT2ATP53
SCHEMBL11252575 0.83 APP (0.55) APPGBA1PDE5AMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 US disclosed