SCHEMBL8640666

SCHEMBL8640666

CCNC(=O)Oc1ccc2c(c1)OCN(CCCl)C2=O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.42
BCHE P06276 11/20 0.42
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38

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
SCHEMBL8637479 0.84 ACHE (0.38) ACHEBCHEOPRM1OPRD1OPRK1
SCHEMBL9004593 0.83 LMNA (0.46)
SCHEMBL9171923 0.81 ROCK2 (0.44)
SCHEMBL8640678 0.79 LMNA (0.39)
SCHEMBL8638136 0.76 ACHE (0.38) ACHEBCHEOPRM1OPRD1OPRK1
SCHEMBL8643444 0.74 MAOB (0.44)
SCHEMBL9174102 0.74 CYP19A1 (0.39)
SCHEMBL8981074 0.73 LMNA (0.39)
SCHEMBL9169246 0.72 MAOB (0.38)
SCHEMBL29329861 0.72 ACHE (0.49) ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0566018-B1 Benzoxazinone and benzothiazinone derivatives endowed with cardiovascular activity ITALFARMACO SPA (IT) 1998-08-05 EP disclosed
US-5480882-A Benzoxazinone and benzothiazinone derivatives having cardiovascular activity ITALFARMACO S.P.A. (IT) 1996-01-02 US disclosed
EP-0566018-A2 Benzoxazinone and benzothiazinone derivatives endowed with cardiovascular activity ITALFARMACO S.p.A. (IT) 1993-10-20 EP disclosed