SCHEMBL10180172

SCHEMBL10180172

CCCC(Oc1cccc(C(F)F)c1Cl)C1=NCCN1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 17/20 0.45
▸ ADRA2B P18089 17/20 0.45
▸ ADRA2C P18825 17/20 0.45
▸ NISCH Q9Y2I1 3/20 0.44
▸ HTR1A P08908 4/20 0.43
▸ SLC6A4 P31645 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 2/20 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
SCHEMBL3667267 0.91 ADRA2A (0.46) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL11369733 0.86 ADRA2A (0.53) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL3961636 0.85 NISCH (0.50) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL11377087 0.81 ADRA2A (0.52) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL11352087 0.78 NISCH (0.52) ADRA2AADRA2BADRA2CNISCHHTR1A
Hydrochloric Acid SCHEMBL11346455 0.77 NISCH (0.51) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL11375241 0.76 ADRA2A (0.55) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL3961615 0.75 NISCH (0.52) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL3665555 0.74 ADRA2B (0.56) ADRA2AADRA2BADRA2CNISCHHTR1A
SCHEMBL3661926 0.72 ADRA2B (0.47) ADRA2AADRA2BADRA2CNISCHHTR1A

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
EP-2190823-B1 Halosubstituted aryloxyalkylimidazolines for use as pesticides SYNGENTA PARTICIPATIONS AG (CH) 2012-07-11 — — EP claimed
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