SCHEMBL31442157

SCHEMBL31442157

Cc1ccc(Cl)c(NC2=NCCN2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 11/20 0.64
ADRA2B P18089 10/20 0.55
ADRA2C P18825 10/20 0.55
ADRA1D P25100 7/20 0.55
ADRA1A P35348 7/20 0.55
ADRA1B P35368 7/20 0.55
CFB P00751 1/20 0.53
LMNA P02545 3/20 0.53
CYP2D6 P10635 2/20 0.53
NISCH Q9Y2I1 2/20 0.53
MEN1 O00255 1/20 0.53
SLC22A1 O15245 1/20 0.53
SLC22A3 O75751 1/20 0.53
HTR1A P08908 1/20 0.53
CYP2C9 P11712 1/20 0.53
HRH2 P25021 1/20 0.53
CYP2C19 P33261 1/20 0.53
OPRK1 P41145 1/20 0.53
KMT2A Q03164 1/20 0.53
HIF1A Q16665 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
Tolonidine SCHEMBL29391908 0.88 ADRA2A (0.55) ADRA2AADRA2BADRA2CADRA1DADRA1A
Tolonidine SCHEMBL310600 0.88 ADRA2A (0.55) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL11359884 0.84 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1DADRA1A
Tolonidine SCHEMBL871225 0.79 ADRA2A (0.52) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL9725295 0.78 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL11164242 0.78 ADRA2A (0.49) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL11859273 0.78 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL11154005 0.77 ADRA2A (0.66) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL24658874 0.76 ADRA2A (0.71) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL11757404 0.76 ADRA2A (0.63) ADRA2AADRA2BADRA2CADRA1DADRA1A

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
CN-119331067-A Application of cabbage type rape Bna.A08.SNAT2 protein and encoding gene thereof in salt stress tolerance 西北农林科技大学 2025-01-21 CN disclosed