SCHEMBL3961615

SCHEMBL3961615

CCC(Oc1cccc(C)c1Cl)C1=NCCN1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 3/20 0.52
▸ ADRA2A P08913 14/20 0.50
▸ ADRA2B P18089 14/20 0.50
▸ ADRA2C P18825 14/20 0.50
▸ HTR1A P08908 3/20 0.46
▸ SLC6A4 P31645 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ OPRK1 P41145 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44

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
SCHEMBL3961636 0.90 NISCH (0.50) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL11375241 0.89 ADRA2A (0.55) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL546178 0.88 NISCH (0.50) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL11224297 0.87 NISCH (0.54) NISCHADRA2AADRA2BADRA2CHTR1A
Hydrochloric Acid SCHEMBL9654753 0.86 NISCH (0.53) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL11370259 0.85 ADRA2A (0.54) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL3667267 0.84 ADRA2A (0.46) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL3661926 0.83 ADRA2B (0.47) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL3665555 0.83 ADRA2B (0.56) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL3961590 0.83 NISCH (0.75) NISCHADRA2AADRA2BADRA2CHTR1A

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
WO-2009036908-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-03-26 — — WO disclosed
WO-2009036908-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-03-26 — — WO disclosed
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