SCHEMBL7228348

SCHEMBL7228348

N#CC1(c2cncc(Cl)c2)CC2CCC(C1)N2CCC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.35
DRD2 P14416 6/20 0.33
DRD4 P21917 4/20 0.33
DRD3 P35462 3/20 0.33
HRH1 P35367 3/20 0.33
HTR1A P08908 2/20 0.33
HTR2A P28223 2/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
KMO O15229 3/20 0.32
SLC6A4 P31645 1/20 0.31
HTR7 P34969 1/20 0.31
HTR2B P41595 1/20 0.31
OPRK1 P41145 1/20 0.31
KCNH2 Q12809 1/20 0.31
HCAR2 Q8TDS4 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
SCHEMBL8544996 0.88 DRD2 (0.33) OPRL1DRD2DRD4DRD3HRH1
SCHEMBL7230622 0.86 ALDH1A1 (0.35) CHEK1ALDH1A1
SCHEMBL7221392 0.84 OPRL1 (0.37) OPRL1
SCHEMBL8188621 0.83 NPSR1 (0.34) OPRL1HCAR2CHEK1CYP11B2ALDH1A1
SCHEMBL8174171 0.82 OPRL1 (0.36) OPRL1HCAR2CHEK1CYP11B2ALDH1A1
SCHEMBL7229259 0.82 OPRL1 (0.36) OPRL1SLC6A4CYP11B2
SCHEMBL16115574 0.81 OPRL1 (0.33) OPRL1DRD2DRD3HRH1HTR1A
SCHEMBL16135471 0.81 OPRL1 (0.33) OPRL1DRD2DRD3HRH1HTR1A
SCHEMBL7497979 0.81 LTA4H (0.41) OPRL1DRD2DRD4DRD3OPRK1
SCHEMBL7223489 0.80 OPRM1 (0.35) OPRL1DRD2DRD4DRD3HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6573275-B1 Insecticidal compositions comprising and to methods of combatting and controlling insect pests therewith. SYNGENTA LIMITED (GB) 2003-06-03 US disclosed
EP-0828739-B1 BICYCLIC AMINES AS INSECTICIDES SYNGENTA LTD (GB) 2002-09-11 EP disclosed
US-6391883-B1 INSECTICIDES SYNGENTA LIMITED (GB) 2002-05-21 US disclosed
US-6207676-B1 Bicyclic amines ZENECA LIMITED (GB) 2001-03-27 US disclosed
EP-0828739-A1 BICYCLIC AMINES AS INSECTICIDES ZENECA LIMITED (GB) 1998-03-18 EP disclosed
WO-1996037494-A1 BICYCLIC AMINES AS INSECTICIDES ZENECA LIMITED (GB) 1996-11-28 WO disclosed