SCHEMBL8083136

SCHEMBL8083136

CCOC(=O)C1CC=CC2CNCC21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
PKM P14618 1/20 0.39
MEN1 O00255 4/20 0.36
POLB P06746 4/20 0.36
KMT2A Q03164 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 1/20 0.36
AR P10275 1/20 0.35
CA1 P00915 5/20 0.32
CA2 P00918 5/20 0.32
CA12 O43570 4/20 0.32
CA9 Q16790 3/20 0.32
KDM4E B2RXH2 1/20 0.31
MASP2 O00187 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAPDH P04406 1/20 0.31
HSPA1A P0DMV8 1/20 0.31
THRB P10828 1/20 0.31
HSPA8 P11142 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL8201372 0.77 ALDH1A1 (0.32) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL7851194 0.76 NFKB1 (0.39) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL8693428 0.76 NFKB1 (0.39) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL7851189 0.76 NFKB1 (0.39) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL7851192 0.76 NFKB1 (0.39) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL8693432 0.76 NFKB1 (0.39) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL8091097 0.76 KMT2A (0.38) MEN1POLBKMT2AGAAKDM4E
SCHEMBL8089773 0.75
SCHEMBL417335 0.75 MEN1 (0.44) MAPTPKMMEN1POLBKMT2A
SCHEMBL418653 0.75 MEN1 (0.44) MAPTPKMMEN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588166-B1 Antibacterial 7-isoindolinyl-quinolone and naphthyridone derivatives BAYER AG (DE) 1996-06-05 EP claimed
US-6018054-A INTERMEDIATE COMPOUNDS FOR PREPARING NOVEL QUINOLONE AND NAPHTHYRIDONE DERIVATIVES WHICH ARE SUBSTITUTED IN THE 7-POSITION BY A PARTIALLY HYDROGENATED ISOINDOLINYL RING, USE AS ANTIBACTERIAL AGENTS AND AS FEED ADDITIVES BAYER AKTIENGESELLSCHAFT (DE) 2000-01-25 US disclosed
US-5618815-A ANTIBACTERIAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1997-04-08 US disclosed
US-5556979-A ANIMAL FEEDS BAYER AKTIENGESELLSCHAFT (DE) 1996-09-17 US disclosed
US-5508278-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-04-16 US disclosed