SCHEMBL11242767

SCHEMBL11242767

CCOc1nc(C)nc(Cl)c1NC1=NCCN1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2C P18825 9/20 0.74
▸ ADRA2A P08913 8/20 0.74
▸ ADRA2B P18089 8/20 0.74
▸ ADRA1A P35348 6/20 0.74
▸ LMNA P02545 5/20 0.74
▸ NISCH Q9Y2I1 3/20 0.74
▸ HTR1A P08908 2/20 0.74
▸ HRH2 P25021 2/20 0.74
▸ CYP2C19 P33261 2/20 0.74
▸ BLM P54132 4/20 0.73
▸ ALOX15 P16050 1/20 0.73
▸ PMP22 Q01453 1/20 0.73
▸ TDP1 Q9NUW8 1/20 0.73
▸ CFB P00751 2/20 0.44
▸ HTR1D P28221 4/20 0.43
▸ ADRA1D P25100 4/20 0.43
▸ ADRA1B P35368 4/20 0.43
▸ CYP2D6 P10635 3/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ MEN1 O00255 1/20 0.43

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
Moxonidine SCHEMBL49143 0.85 ADRA2C (1.00) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL29363838 0.85 ADRA2C (1.00) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL8390103 0.85 ADRA2C (1.00) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL1321306 0.84 BLM (1.00) ADRA2CADRA2AADRA2BADRA1ALMNA
SCHEMBL2333058 0.83 ADRA2C (0.76) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL1230620 0.83 BLM (0.97) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL30484346 0.83 BLM (0.97) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL8007695 0.79 ADRA2C (0.86) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL5006894 0.79 ADRA2C (0.86) ADRA2CADRA2AADRA2BADRA1ALMNA
Moxonidine SCHEMBL5903622 0.77 ADRA2C (0.77) ADRA2CADRA2AADRA2BADRA1ALMNA

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
US-4323570-A HYPOTENSIVE AGENTS AND TREATING GLAUCOMA BEIERSDORF AKTIENGESELLSCHAFT (DE) 1982-04-06 — — US disclosed
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