SCHEMBL1717847

SCHEMBL1717847

CC(C)(C=S)c1cccc2c1CCC2NC1=NCCO1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 13/20 0.49
ADRA2B P18089 13/20 0.49
ADRA2C P18825 13/20 0.49
ADRA1A P35348 4/20 0.49
TRPV1 Q8NER1 2/20 0.32
TAAR1 Q96RJ0 1/20 0.31

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
SCHEMBL2216731 0.79 ADRA2A (0.57) ADRA2AADRA2BADRA2CADRA1ATRPV1
SCHEMBL1723548 0.71 ADRA2B (0.84) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL4054961 0.68 ADRA2A (0.59) ADRA2AADRA2BADRA2CADRA1ATRPV1
SCHEMBL1724062 0.66 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL2215859 0.63 ADRA2A (0.56) ADRA2AADRA2BADRA2CADRA1ATAAR1
SCHEMBL6369306 0.63 ADRA2A (0.58) ADRA2AADRA2BADRA2CADRA1ATAAR1
SCHEMBL11332296 0.61 ADRA2A (0.62) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL15975257 0.61 ADRA2A (0.55) ADRA2AADRA2BADRA2CADRA1ATAAR1
SCHEMBL13963571 0.61 ADRA2A (0.62) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL6897370 0.59 ADRA2A (0.54) ADRA2AADRA2BADRA2CADRA1ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960369-B1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2012-01-11 EP claimed
US-7981437-B2 Indanyl- and tetrahydronaphthyl-amino-azoline compounds for combating animal pests BASF SE (DE) 2011-07-19 US claimed
US-20080293569-A1 Indanyl- and Tetrahydronaphthyl-Amino-Azoline Compounds for Combating Animal Pests BASF SE (DE) 2008-11-27 US claimed
EP-1960369-A1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2008-08-27 EP claimed
WO-2007060121-A1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2007-05-31 WO claimed
EP-1960369-B1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2012-01-11 EP disclosed
US-7981437-B2 Indanyl- and tetrahydronaphthyl-amino-azoline compounds for combating animal pests BASF SE (DE) 2011-07-19 US disclosed
US-20080293569-A1 Indanyl- and Tetrahydronaphthyl-Amino-Azoline Compounds for Combating Animal Pests BASF SE (DE) 2008-11-27 US disclosed
EP-1960369-A1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2008-08-27 EP disclosed
WO-2007060121-A1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2007-05-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080293569-A1 Indanyl- and Tetrahydronaphthyl-Amino-Azoline Compounds for Combating Animal Pests INMT, AIPL1, AADAT ADRA2A 1392/4885ADRA2B 875/4885ADRA2C 669/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.