SCHEMBL8323716

SCHEMBL8323716

COC(=O)C1C(=O)N(Cc2ccc(Br)cc2F)C(=O)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 3/20 0.54
CHRM5 P08912 1/20 0.46
MAPT P10636 3/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GRM5 P41594 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
P2RX7 Q99572 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
SCHEMBL8320456 0.89 AKR1B1 (0.66) AKR1B1CHRM5MAPTGRM5P2RX7
SCHEMBL9535759 0.87 AKR1B1 (0.60) AKR1B1CHRM5MEN1CYP1A2CYP2C9
SCHEMBL9385856 0.87 AKR1B1 (0.49) AKR1B1CHRM5MAPT
SCHEMBL9385583 0.87 AKR1B1 (0.54) AKR1B1CHRM5MAPT
SCHEMBL9383524 0.80 AKR1B1 (0.45) AKR1B1CHRM5MAPTLMNATSHR
SCHEMBL9684857 0.79 AKR1B1 (0.79) AKR1B1CHRM5MEN1CYP1A2CYP2C9
SCHEMBL11791998 0.77 KMT2A (0.53) LMNATSHRL3MBTL1MEN1KMT2A
SCHEMBL9872084 0.75 AKR1B1 (0.79) AKR1B1CHRM5MAPTGRM5
SCHEMBL9383581 0.74 ALDH1A1 (0.48) MAPTTSHRL3MBTL1MEN1CYP1A2
SCHEMBL9870040 0.72 AKR1B1 (0.73) AKR1B1CHRM5MAPTGRM5P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555327-B1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO-[ISOQUINOLINE- 4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PROD (US) 1999-01-13 EP disclosed
EP-0553263-B1 1'-AMINOSPIRO-[ISOQUINOLINE-4(1H),3'-PYRROLIDINE]- 1,2',3,5'(2H)-TETRONES AND ANALOGS THEREOF USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PROD (US) 1998-08-05 EP disclosed
EP-0519600-B1 Process and intermediate for making isoquinoline derivatives AMERICAN HOME PROD (US) 1997-06-11 EP disclosed
EP-0365324-B1 Spiro-isoquinoline-pyrrolidine tetrones and analogs thereof useful as aldose reductase inhibitors AMERICAN HOME PROD (US) 1994-05-04 EP disclosed
EP-0555327-A1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO-[ISOQUINOLINE- 4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PRODUCTS CORPORATION (US) 1993-08-18 EP disclosed
EP-0553263-A1 1'-AMINOSPIRO-[ISOQUINOLINE-4(1H),3'-PYRROLIDINE]- 1,2',3,5'(2H)-TETRONES AND ANALOGS THEREOF USEFUL AS ALDOSE REDUCTASE INHIBITORS IN VIVO AMERICAN HOME PRODUCTS CORPORATION (US) 1993-08-04 EP disclosed
EP-0519600-A1 Process and intermediate for making isoquinoline derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1992-12-23 EP disclosed
US-5169948-A Process and intermediates for the preparation of spiro[isoquinoline-4(1H),3-pyrrolidine]1,2,3,5 (2H)-tetrones which are useful as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1992-12-08 US disclosed
US-5130425-A Antidiabetic agents spiro azetidine-2,4'(1'H)-isoquinoline! 1',3',4(2'H)-triones AMERICAN HOME PRODUCTS CORPORATION (US) 1992-07-14 US disclosed
WO-1992006974-A1 ALKYLIDENE ANALOGS OF 1'-AMINOSPIRO[ISOQUINOLINE-4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES USEFUL AS ALDOSE REDUCTASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-30 WO disclosed
WO-1992006975-A1 1'-AMINOSPIRO[ISOQUINOLINE-4(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONES AND ANALOGS THEREOF USEFUL AS ALDOSE REDUCTASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-30 WO disclosed
US-5106978-A Process and intermediates for the preparation of spiro(isoquinoline-4(1H), 3'-pyrrolidine)-1,2', 3,5'(2H)-tetrones which are useful as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-21 US disclosed
US-5102886-A 1'-aminospiro[isoquinoline-4(1H),3'-pyrrolidine]-1,2',3,5'(2H)-tetrones and analogs thereof useful as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-07 US disclosed
US-5081241-A Diabetes AMERICAN HOME PRODUCTS CORPORATION (US) 1992-01-14 US disclosed
EP-0458549-A1 N-alkyl-spiro-isoquinoline-pyrrolidine tetrones and analogs thereof useful as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1991-11-27 EP disclosed
US-5068332-A Antidiabetic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-11-26 US disclosed
US-5045544-A Preventing or relieving neuropathy, nephropathy, retinopathy or cataracts in diabetic mammals AMERICAN HOME PRODUCTS CORPORATION (US) 1991-09-03 US disclosed
US-4983613-A Acetamides; treatment of neuropathy, nephropathy, retinopathy or cataracts in diabetic mammals AMERICAN HOME PRODUCTS CORPORATION (US) 1991-01-08 US disclosed
US-4927831-A PREVENTION OF DIABETES MELLITUS ASSOCIATED COMPLICATIONS AMERICAN HOME PRODUCTS (US) 1990-05-22 US disclosed
EP-0365324-A1 Spiro-isoquinoline-pyrrolidine tetrones and analogs thereof useful as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1990-04-25 EP disclosed