SCHEMBL8936714

SCHEMBL8936714

O=C(O)c1cc(-c2ccccc2)c(=O)n2c1-c1cc(Cl)ccc1CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.38
DHODH Q02127 1/20 0.38
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SERPINE1 P05121 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
GRIK1 P39086 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
FABP3 P05413 1/20 0.36
FABP4 P15090 1/20 0.36
HSD17B3 P37058 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
NOTUM Q6P988 1/20 0.35
GAA P10253 1/20 0.35
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 0.35

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
SCHEMBL9334794 0.88 TSHR (0.41) KDM4EALDH1A1TP53GAA
SCHEMBL9334812 0.88 GABRA1 (0.48) KMT2AKDM4EMAPTNPSR1PTGDR2
SCHEMBL9334779 0.87 TSHR (0.40) KMT2AKDM4EMAPTNPSR1SERPINE1
SCHEMBL9338390 0.86 GAA (0.44) HSP90AA1KMT2APTGDR2ALDH1A1GAA
Hydrochloric Acid SCHEMBL9338296 0.85 TSHR (0.49) KMT2AKDM4EMAPTNPSR1ALDH1A1
SCHEMBL9338270 0.85 KCNK3 (0.48) KDM4EMAPTPTGDR2ALDH1A1TP53
SCHEMBL9336250 0.85 KDM4E (0.40) KMT2AKDM4EALDH1A1
SCHEMBL9335866 0.85 ALDH1A1 (0.39) KDM4EMAPTALDH1A1TP53GAA
SCHEMBL9338503 0.85 KDM4E (0.49) KMT2AKDM4EALDH1A1GAA
SCHEMBL9334715 0.85 HCRTR1 (0.39) TP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578728-A Process for the preparation of a benzo(a)quinolizione derivative HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US claimed
JP-7188229-A None JP disclosed
US-5578728-A Process for the preparation of a benzo(a)quinolizione derivative HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US disclosed
US-5578728-A Process for the preparation of a benzo(a)quinolizione derivative HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US disclosed
US-5561233-A Process for the preparation of an intermediate of a benzo[a]quinolizinone derivative HOFFMANN-LA ROCHE INC. (US) 1996-10-01 US disclosed
US-5561233-A Process for the preparation of an intermediate of a benzo[a]quinolizinone derivative HOFFMANN-LA ROCHE INC. (US) 1996-10-01 US disclosed
JP-H07188229-A PREPARATION OF BENZO(A)QUINOLIZINONE DERIVATIVE F HOFFMANN LA ROCHE AG 1995-07-25 JP disclosed
US-5326769-A Treatment of sleep disorders HOFFMANN-LA ROCHE INC. (US) 1994-07-05 US disclosed
US-5321021-A Tricyclic pyridine derivatives HOFFMANN-LA ROCHE INC. (US) 1994-06-14 US disclosed
US-5281711-A (S)-1-[10-chloro-6,7-dihydro-4-oxo-3-phenyl-4H-benzo[a]quino-lizin-1-yl)carbonyl]-3-ethoxypyrrolidine HOFFMANN-LA ROCHE INC. (US) 1994-01-25 US disclosed
CN-1016871-B Process for the preparation of bicyclic and tricyclic pyridine derivatives HOFFMANN LA ROCHE 7 CO F (CN) 1992-06-03 CN disclosed
US-5036066-A Muscle relaxants, anxiolytic agents, anticonvulsants HOFFMANN-LA ROCHE INC. (US) 1991-07-30 US disclosed
US-4889848-A 4-OXO-4H-BENZO(A)QUINOLIZINES; MUSCLE RELAXANTS; SEDATIVES; ANTICONVULSANTS; ANXIOLYTIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1989-12-26 US disclosed
US-4735940-A Tricyclic pyridine derivatives and pharmaceutical compositions HOFFMANN-LA ROCHE INC. (US) 1988-04-05 US disclosed
CN-85108120-A The preparation of tricyclic pyridine derivative and application thereof 1986-11-05 CN disclosed