SCHEMBL9820148

SCHEMBL9820148

Clc1cc(C2CC2)ccc1NC1=NCCN1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 13/20 0.50
ADRA2B P18089 11/20 0.50
ADRA2C P18825 11/20 0.50
ADRA1A P35348 9/20 0.50
ADRA1D P25100 8/20 0.50
ADRA1B P35368 8/20 0.50
HSD17B10 Q99714 2/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
BLM P54132 4/20 0.49
LMNA P02545 5/20 0.49
NISCH Q9Y2I1 3/20 0.49
CYP2D6 P10635 3/20 0.49
HRH2 P25021 2/20 0.49
HTR1A P08908 2/20 0.49
MEN1 O00255 1/20 0.49
SLC22A1 O15245 1/20 0.49
SLC22A3 O75751 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL29458121 0.81 ADRA2A (0.56) ADRA2AADRA2BADRA2CADRA1AADRA1D
SCHEMBL11759345 0.81 ADRA2A (0.56) ADRA2AADRA2BADRA2CADRA1AADRA1D
Tolonidine SCHEMBL310600 0.78 ADRA2A (0.55) ADRA2AADRA2BADRA2CADRA1AADRA1D
Tolonidine SCHEMBL29391908 0.78 ADRA2A (0.55) ADRA2AADRA2BADRA2CADRA1AADRA1D
SCHEMBL11859273 0.74 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1AADRA1D
SCHEMBL6935250 0.73 ADRA2A (0.57) ADRA2AADRA2BADRA2CLMNANISCH
Hydrochloric Acid SCHEMBL7866932 0.72 ADRA2A (0.56) ADRA2AADRA2BADRA2CLMNANISCH
SCHEMBL11359884 0.72 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1AADRA1D
Tolonidine SCHEMBL871225 0.70 ADRA2A (0.52) ADRA2AADRA2BADRA2CADRA1AADRA1D
SCHEMBL31442157 0.70 ADRA2A (0.64) ADRA2AADRA2BADRA2CADRA1AADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0170193-B1 FEEDSTUFF ADDITIVE FOR THE GROWTH PROMOTING OF AGRICULTURAL USEFUL ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1991-12-27 EP claimed
US-4853402-A 2-SUBSTITUTED-2-IMIDAZOLINES BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1989-08-01 US claimed
EP-0170193-B1 FEEDSTUFF ADDITIVE FOR THE GROWTH PROMOTING OF AGRICULTURAL USEFUL ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1991-12-27 EP disclosed
US-4970208-A OXAZOLO-OR THIAZOLO 5,4-d!AZEPINES BOEHRINGER INGELHEIM GMBH (DE) 1990-11-13 US disclosed
US-4853402-A 2-SUBSTITUTED-2-IMIDAZOLINES BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1989-08-01 US disclosed
EP-0170193-A2 Feedstuff additive for the growth promoting of agricultural useful animals BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1986-02-05 EP disclosed