SCHEMBL7221965

SCHEMBL7221965

CN1C2CCC1CC(C#N)(c1cc(Cl)nc(Cl)c1)C2

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.43
OPRM1 P35372 3/20 0.34
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 4/20 0.33
SLC6A2 P23975 1/20 0.33

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
SCHEMBL7222126 0.87 OPRL1 (0.37) OPRL1SLC6A4SLC6A3
SCHEMBL7223279 0.83 OPRL1 (0.43) OPRL1OPRM1SLC6A4SLC6A3SLC6A2
SCHEMBL7228235 0.82 OPRL1 (0.36) OPRL1
SCHEMBL6617335 0.79 OPRL1 (0.41) OPRL1OPRM1SLC6A4SLC6A3SLC6A2
SCHEMBL7230532 0.79 CHRNB2 (0.44) OPRL1OPRM1
SCHEMBL6994236 0.79 OPRL1 (0.39) OPRL1SLC6A4SLC6A3SLC6A2
SCHEMBL7229138 0.78 OPRL1 (0.43) OPRL1OPRM1SLC6A4SLC6A3SLC6A2
SCHEMBL6620275 0.76 OPRL1 (0.36) OPRL1
SCHEMBL7230071 0.76 OPRL1 (0.45) OPRL1OPRM1SLC6A4SLC6A3SLC6A2
SCHEMBL1843464 0.75 OPRL1 (0.60) OPRL1OPRM1SLC6A4SLC6A3SLC6A2

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