SCHEMBL7284938

SCHEMBL7284938

O=C(O)Oc1cc(-c2ccccc2)c(=O)n2c1-c1cc(Cl)ccc1CC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
ACHE P22303 1/20 0.34
HSD17B3 P37058 2/20 0.34
PDE7A Q13946 1/20 0.34
PDE3A Q14432 1/20 0.34
PDE10A Q9Y233 1/20 0.34
NOTUM Q6P988 1/20 0.33
EIF4EBP1 Q13541 1/20 0.33
CHRM3 P20309 1/20 0.33
AKR1C3 P42330 2/20 0.33
AKR1C1 Q04828 1/20 0.33
NPY5R Q15761 1/20 0.33
FABP4 P15090 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL10367806 0.90 ALDH1A1 (0.38) MAPTKMT2AKDM4ENPSR1PTGDR2
SCHEMBL10368214 0.88 MAPT (0.39) MAPTKMT2AKDM4ENPSR1ALDH1A1
SCHEMBL27273993 0.87 PDE10A (0.43) MAPTKDM4ENPSR1ACHEHSD17B3
SCHEMBL8936714 0.83 HSP90AA1 (0.38) MAPTKMT2AKDM4ENPSR1PTGDR2
SCHEMBL9338054 0.81 HSD17B3 (0.38) MAPTKMT2AKDM4ENPSR1PTGDR2
SCHEMBL9334812 0.81 GABRA1 (0.48) MAPTKMT2AKDM4ENPSR1PTGDR2
SCHEMBL10369526 0.81 KMT2A (0.35) MAPTKMT2AKDM4ENPSR1NOTUM
SCHEMBL9335063 0.81 GABRA1 (0.40) MAPTKMT2AKDM4ENPSR1HSD17B3
SCHEMBL9335056 0.81 GABRA1 (0.36) MAPTKMT2AKDM4ENPSR1HSD17B3
SCHEMBL10369849 0.79 HSD17B3 (0.37) MAPTKMT2AKDM4ENPSR1PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650966-A1 Process for the preparation of a benzo(a)quinolizinone derivative F. HOFFMANN-LA ROCHE AG (CH) 1995-05-03 EP claimed
EP-0496274-B1 Tricyclic pyridone derivative HOFFMANN LA ROCHE (CH) 1996-07-03 EP disclosed
EP-0650966-A1 Process for the preparation of a benzo(a)quinolizinone derivative F. HOFFMANN-LA ROCHE AG (CH) 1995-05-03 EP disclosed
EP-0650966-A1 Process for the preparation of a benzo(a)quinolizinone derivative F. HOFFMANN-LA ROCHE AG (CH) 1995-05-03 EP disclosed
EP-0496274-A1 Tricyclic pyridone derivative F. Hoffmann-La Roche AG (CH) 1992-07-29 EP disclosed
EP-0183994-B1 TRICYCLIC PYRIDONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1990-03-21 EP disclosed
EP-0183994-A1 Tricyclic pyridone derivatives F. HOFFMANN-LA ROCHE AG (CH) 1986-06-11 EP disclosed