SCHEMBL4486245

SCHEMBL4486245

N#[N+]C(N)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.50
F2 P00734 1/20 0.50
HTR2A P28223 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39
LMNA P02545 1/20 0.39
HIF1A Q16665 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 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
SCHEMBL6923382 0.76 DPP4 (0.52) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL4149963 0.72 DPP4 (0.41) DPP4F2HTR2ATAAR1LMNA
SCHEMBL11334471 0.69
SCHEMBL7208200 0.69 SCN4A (0.45) DPP4F2HTR2ATAAR1
SCHEMBL11571828 0.68 TSHR (0.46) ADRA2AADRA2CLMNAHIF1AKDM4E
Diphenylmethanol SCHEMBL10868602 0.67 SMN1; SMN2 (0.61) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL239938 0.67 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
Aminodiphenylmethane SCHEMBL7841 0.67 DPP4 (0.65) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL851654 0.67 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
Diphenylmethanol SCHEMBL41571 0.67 SMN1; SMN2 (0.61) ADRA2AADRA2CLMNAHIF1AKDM4E

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
EP-2121814-A2 METHOD FOR PREPARING AN ORGANIC FILM AT THE SURFACE OF A SOLID SUBSTRATEIN NON-ELECTROCHEMICAL CONDITIONS, SOLID SUBSTRATE THUS FORMED AND PREPARATION KIT COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2009-11-25 EP disclosed
WO-2008078052-A2 METHOD FOR PREPARING AN ORGANIC FILM AT THE SURFACE OF A SOLID SUBSTRATEIN NON-ELECTROCHEMICAL CONDITIONS, SOLID SUBSTRATE THUS FORMED AND PREPARATION KIT COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-07-03 WO disclosed