SCHEMBL7067587

SCHEMBL7067587

COc1cccc(C(=O)N(NC(C)(C)C)C(=O)c2cc(C)cc(C)c2)c1C

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.64
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 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
SCHEMBL17416606 0.93 ABCB1 (0.56) ABCB1NPC1RAB9AKCNK3KCNK9
SCHEMBL9099071 0.88 ABCB1 (0.53) ABCB1NPC1RAB9AKCNK3KCNK9
SCHEMBL17416624 0.88 ABCB1 (0.53) ABCB1NPC1RAB9AKCNK3KCNK9
SCHEMBL17416625 0.87 ABCB1 (0.52) ABCB1NPC1RAB9AKCNK3KCNK9
SCHEMBL9099193 0.87 ABCB1 (0.49) ABCB1KCNK3KCNK9
SCHEMBL9104050 0.86 ABCB1 (0.48) ABCB1
SCHEMBL2482845 0.86 ABCB1 (0.51) ABCB1NPC1RAB9A
SCHEMBL17416630 0.84 ABCB1 (0.46) ABCB1NPC1RAB9AKCNK3KCNK9
SCHEMBL23291872 0.82 ABCB1 (0.56) ABCB1NPC1RAB9AKCNK3KCNK9
SCHEMBL9101450 0.82 ABCB1 (0.56) ABCB1NPC1RAB9AKCNK3KCNK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115530173-A Synergistic pesticide for preventing and treating sugarcane borers 广西壮族自治区农业科学院 2022-12-30 CN disclosed
CN-113826633-B Pesticide for preventing and treating sugarcane borers 广西壮族自治区农业科学院 2022-11-18 CN disclosed
CN-113826633-A Pesticide for preventing and treating sugarcane borers 广西壮族自治区农业科学院 2021-12-24 CN disclosed
EP-1367891-A1 PHARMACEUTICAL COMPOSITION CONTAINING AMINOACETONITRILE COMPOUNDS AND THE USE THEREOF FOR THE PREPARATION OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF ENDOPARASITIC PESTS IN ANIMALS Novartis AG (CH) 2003-12-10 EP disclosed
EP-1230239-A1 PESTICIDAL AMINOHETEROCYCLAMIDE COMPOUNDS Novartis AG (CH) 2002-08-14 EP disclosed
WO-2002060257-A1 PHARMACEUTICAL COMPOSITION CONTAINING AMINOACETONITRIL COMPOUNDS AND THE USE THEREOF FOR THE PREPARATION OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF ENDOPARASITIC PESTS IN ANIMALS NOVARTIS AG (CH) 2002-08-08 WO disclosed
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO disclosed
WO-2001046165-A2 N-HETEROARYL-AMIDES AND THEIR USE AS PARASITICIDES NOVARTIS AG (CH) 2001-06-28 WO disclosed
WO-2001036367-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2001-05-25 WO disclosed
WO-2001036372-A1 ORGANIC COMPOUNDS AND THEIR USE IN THE CONTROL OF ECTOPARASITES NOVARTIS AG (CH) 2001-05-25 WO disclosed
WO-2001036415-A1 PESTICIDAL AMINOHETEROCYCLAMIDE COMPOUNDS NOVARTIS AG (CH) 2001-05-25 WO disclosed
EP-0900024-A1 PESTICIDAL COMPOSITIONS Novartis AG (CH) 1999-03-10 EP disclosed
WO-1997040692-A1 PESTICIDAL COMPOSITIONS NOVARTIS AG (CH) 1997-11-06 WO disclosed