SCHEMBL1724062

SCHEMBL1724062

c1ccc2c(c1)CCCC2NC1=NCCO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 6/20 1.00
ADRA2B P18089 6/20 1.00
ADRA2C P18825 6/20 1.00
ADRA1A P35348 3/20 1.00
LMNA P02545 3/20 0.60
HDAC6 Q9UBN7 1/20 0.48
KCNN3 Q9UGI6 1/20 0.48
HTT P42858 1/20 0.44
KDM4E B2RXH2 2/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL1723548 0.92 ADRA2B (0.84) ADRA2AADRA2BADRA2CADRA1ALMNA
SCHEMBL1218576 0.80 ADRA2A (0.67) ADRA2AADRA2BADRA2CADRA1ALMNA
SCHEMBL13963571 0.77 ADRA2A (0.62) ADRA2AADRA2BADRA2CADRA1ALMNA
SCHEMBL11332296 0.77 ADRA2A (0.62) ADRA2AADRA2BADRA2CADRA1ALMNA
SCHEMBL1669616 0.75 LMNA (1.00) ADRA2AADRA2BADRA2CADRA1ALMNA
SCHEMBL1669553 0.75 LMNA (1.00) ADRA2AADRA2BADRA2CADRA1ALMNA
SCHEMBL4054961 0.74 ADRA2A (0.59) ADRA2AADRA2BADRA2CADRA1ATSHR
SCHEMBL6369306 0.74 ADRA2A (0.58) ADRA2AADRA2BADRA2CADRA1ATSHR
SCHEMBL2216731 0.73 ADRA2A (0.57) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL3738928 0.73 ADRA2A (0.57) ADRA2AADRA2BADRA2CADRA1ATSHR

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0251453-A2 Substituted amino-dihydrooxazoles, -thiazoles and -imidazoles, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-01-07 EP claimed
US-4256755-A Method of using N-substituted dihydro-2-oxazolamines as analgesics E. I. DU PONT DE NEMOURS & COMPANY (US) 1981-03-17 US claimed
US-8178567-B2 Insecticidal substituted amino heterocyclic and heteroaryl derivatives FMC CORPORATION (US) 2012-05-15 US disclosed
US-8178567-B2 Insecticidal substituted amino heterocyclic and heteroaryl derivatives FMC CORPORATION (US) 2012-05-15 US disclosed
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-7981437-B2 Indanyl- and tetrahydronaphthyl-amino-azoline compounds for combating animal pests BASF SE (DE) 2011-07-19 US disclosed
US-20100280085-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 US disclosed
US-20100167925-A1 Substituted Azolin-2-yl-Amino Compounds BASF SE (DE) 2010-07-01 US disclosed
US-20100137385-A1 Insecticidal Substituted Amino Heterocyclic and Heteroaryl Derivatives BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
US-20100137385-A1 Insecticidal Substituted Amino Heterocyclic and Heteroaryl Derivatives BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
US-20080293569-A1 Indanyl- and Tetrahydronaphthyl-Amino-Azoline Compounds for Combating Animal Pests BASF SE (DE) 2008-11-27 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-2008017649-A1 SUBSTITUTED AZOLIN-2-YL-AMINO COMPOUNDS BASF SE (DE) 2008-02-14 WO disclosed
WO-2007093292-A2 INSECTICIDAL SUBSTITUTED AMINO HETEROCYCLIC AND HETEROARYL DERIVATIVES BAYER CROPSCIENCE AG (DE) 2007-08-23 WO disclosed
WO-2007060121-A1 INDANYL-AND TETRAHYDRONAPHTHYL-AMINO-AZOLINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2007-05-31 WO disclosed
US-4861789-A Dihydro-indene-amine-dihydrooxazoles BEECHAM GROUP PLC (GB) 1989-08-29 US disclosed
EP-0251453-A2 Substituted amino-dihydrooxazoles, -thiazoles and -imidazoles, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-01-07 EP disclosed
US-4256755-A Method of using N-substituted dihydro-2-oxazolamines as analgesics E. I. DU PONT DE NEMOURS & COMPANY (US) 1981-03-17 US 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 (4 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-20100137385-A1 Insecticidal Substituted Amino Heterocyclic and Heteroaryl Derivatives DDT, AAAS, DDC ADRA2A 194/4885ADRA2B 118/4885ADRA2C 124/4885
US-20100167925-A1 Substituted Azolin-2-yl-Amino Compounds CBR3, NR2C2, HRH3 ADRA2A 861/4885ADRA2B 446/4885ADRA2C 253/4885
US-20080293569-A1 Indanyl- and Tetrahydronaphthyl-Amino-Azoline Compounds for Combating Animal Pests INMT, AIPL1, AADAT ADRA2A 1392/4885ADRA2B 875/4885ADRA2C 669/4885
US-20100280085-A1 CHEMICAL COMPOUNDS ACHE, TYR, COX6B1 ADRA2A 2634/4885ADRA2B 2755/4885ADRA2C 1481/4885

“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.