SCHEMBL8973679

SCHEMBL8973679

NOCCCCc1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.55
AGXT P21549 2/20 0.54
TAAR1 Q96RJ0 3/20 0.50
MAOB P27338 2/20 0.44
LOXL2 Q9Y4K0 1/20 0.43
AOC3 Q16853 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
SCHEMBL5798706 0.94 IDO1 (0.63) IDO1AGXTTAAR1MAOBLOXL2
SCHEMBL5795896 0.85 IDO1 (0.60) IDO1AGXTTAAR1MAOBLOXL2
SCHEMBL10574057 0.82 TAAR1 (0.62) IDO1AGXTTAAR1MAOBLOXL2
SCHEMBL8722410 0.81 TAAR1 (0.46) IDO1AGXTTAAR1MAOB
SCHEMBL11669981 0.81 TAAR1 (0.46) IDO1AGXTTAAR1MAOB
SCHEMBL10571903 0.79 TAAR1 (0.59) IDO1TAAR1MAOBLOXL2AOC3
SCHEMBL11959866 0.79 TAAR1 (0.45) TAAR1MAOBAOC3
SCHEMBL8973811 0.79 IDO1 (0.55) IDO1AGXTTAAR1MAOBAOC3
SCHEMBL2146745 0.78 IDO1 (0.87) IDO1AGXTMAOB
SCHEMBL11959855 0.78 TAAR1 (0.44) TAAR1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0456089-B1 Cyclohexenonoximethers, process for their production and their application as herbicides BASF AG (DE) 1996-04-03 EP disclosed
US-5364833-A Controlling grasses in wheat and rice crops BASF AKTIENGESELLSCHAFT (DE) 1994-11-15 US disclosed
EP-0456090-B1 Herbicidal agents containing cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF AG (DE) 1994-07-13 EP disclosed
US-5076831-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1991-12-31 US disclosed
EP-0456090-A2 Herbicidal agents containing cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF Aktiengesellschaft (DE) 1991-11-13 EP disclosed
EP-0456089-A1 Cyclohexenonoximethers, process for their production and their application as herbicides BASF Aktiengesellschaft (DE) 1991-11-13 EP disclosed
EP-0430004-A2 1,8-Naphthalimides as antidotes BASF Aktiengesellschaft (DE) 1991-06-05 EP disclosed