SCHEMBL8327989

SCHEMBL8327989

CCOC(=O)C(C(=O)O)c1c(Cl)cccc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.44
TSHR P16473 2/20 0.44
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
USP2 O75604 1/20 0.40
MT-CO2 P00403 1/20 0.40
TTR P02766 1/20 0.40
PLA2G1B P04054 1/20 0.40
CYP1A2 P05177 1/20 0.40
PGR P06401 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
AR P10275 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL8325160 0.83 MMP8 (0.51) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL2836425 0.83 KMT2A (0.47) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL8323986 0.83 MMP8 (0.44) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL8327982 0.82 TSHR (0.49) TSHRALDH1A1MEN1KMT2ALMNA
SCHEMBL11436019 0.77 ALDH1A1 (0.45) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL8325804 0.76 MMP8 (0.53) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL9388700 0.75 HTT (0.46) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL1717481 0.75 MMP8 (0.46) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL2836423 0.75 KMT2A (0.50) MMP8TSHRALDH1A1MEN1KMT2A
SCHEMBL30364408 0.74 NLRP3 (0.47) TSHRALDH1A1MEN1KMT2ALMNA

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 12 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-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-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
US-5068332-A Antidiabetic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-11-26 US disclosed