SCHEMBL9686747

SCHEMBL9686747

CCCN1CC(=O)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
LMNA P02545 1/20 0.32
PARP1 P09874 1/20 0.32
HTT P42858 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
ACHE P22303 2/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL8597006 0.85 ALDH1A1 (0.44) ALDH1A1GAAMAPTTHRBACHE
SCHEMBL4139100 0.84 MGLL (0.43) ALDH1A1GAAMAPTTHRBHTT
SCHEMBL5755608 0.84 MGLL (0.43) ALDH1A1GAAMAPTTHRBHTT
SCHEMBL8302210 0.81
SCHEMBL10718524 0.80 L3MBTL1 (0.42) L3MBTL1ALDH1A1GAAMAPTTHRB
SCHEMBL16196108 0.74 L3MBTL1 (0.39) L3MBTL1HDAC6LMNAPARP1HTT
SCHEMBL16196097 0.73 L3MBTL1 (0.38) L3MBTL1HDAC6LMNAPARP1HTT
SCHEMBL17898499 0.71
SCHEMBL14453735 0.71 PIK3CD (0.48) L3MBTL1ALDH1A1GAAPARP1POLB
SCHEMBL16197915 0.71 L3MBTL1 (0.41) L3MBTL1HDAC6LMNAPARP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0245053-B1 HETEROCYCLIC FUSED TRICYCLIC COMPOUNDS ICI AMERICAS INC. (US) 1992-11-25 EP disclosed
US-5118688-A TETRAHYDROPYRIDOQUINOLONE DERIVATIVES USEFUL AS ANXIOLYTIC AGENTS ICI AMERICAS INC. (US) 1992-06-02 US disclosed
US-4975435-A Certain 1H-pyrrold[3,4-b]quinolin-1-one-9-amino-2,3-dihydro derivatives useful for treating anxiety ICI AMERICAS INC. (US) 1990-12-04 US disclosed
EP-0245053-A1 Heterocyclic fused tricyclic compounds ICI AMERICAS INC. (US) 1987-11-11 EP disclosed
US-4645838-A Pyrazolopyridine compounds, and intermediates, useful as anxiolytic agents ICI AMERICAS INC. (US) 1987-02-24 US disclosed
EP-0094175-B1 PYRAZOLOPYRIDINE COMPOUNDS ICI AMERICAS INC. (US) 1986-10-29 EP disclosed
US-4563525-A Process for preparing pyrazolopyridine compounds ICI AMERICAS INC. (US) 1986-01-07 US disclosed
US-4511568-A CNS-Depressant pyrazolopyridines ICI AMERICAS INC. (US) 1985-04-16 US disclosed
EP-0094175-A1 Pyrazolopyridine compounds ICI AMERICAS INC. (US) 1983-11-16 EP disclosed