SCHEMBL8944227

SCHEMBL8944227

Cn1c(=O)ccc2c3ccc(Cl)cc3ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 9/20 0.47
BRD4 O60885 2/20 0.44
BRD9 Q9H8M2 2/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
KAT2B Q92831 1/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HCRTR1 O43613 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
MAT2A P31153 1/20 0.43
BRD1 O95696 2/20 0.42
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
RXFP1 Q9HBX9 2/20 0.40
KCNH2 Q12809 1/20 0.40
MCHR1 Q99705 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
SCHEMBL31202712 0.86 BRPF1 (0.62) BRPF1BRD4BRD9CA12CA9
SCHEMBL31743117 0.80 BRPF1 (0.57) BRPF1BRD4BRD9CA12CA9
SCHEMBL8944339 0.77 BRPF1 (0.63) BRPF1BRD4BRD9CA12CA9
SCHEMBL13562249 0.74 ALKBH5 (0.47) MAPTKDM4EHCRTR1CASP1CASP7
SCHEMBL6561368 0.73 CYP2A6 (0.57) LMNAALOX15TSHRALDH1A1SMN1; SMN2
SCHEMBL21979134 0.72 NQO2 (0.61) BRPF1BRD9KAT2BMAPTKDM4E
SCHEMBL7508400 0.71 MAT2A (0.42) MAPTKDM4EHCRTR1CASP1CASP7
SCHEMBL12205409 0.71 CYP2A6 (0.55) LMNAALOX15TSHRALDH1A1SMN1; SMN2
SCHEMBL30727441 0.70 MAT2A (0.50) MAPTKDM4EMAT2ALMNAHPGD
SCHEMBL1921296 0.69 KDM4E (0.53) MAPTKDM4EHCRTR1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0724440-A4 DI- AND TETRA-HYDROBENZO F]QUINOLIN-3-ONES SMITHKLINE BEECHAM CORP (US) 1996-11-20 EP claimed
EP-0724440-A1 DI- AND TETRA-HYDROBENZO F]QUINOLIN-3-ONES SMITHKLINE BEECHAM CORPORATION (US) 1996-08-07 EP claimed
WO-1995005821-A1 DI- AND TETRA-HYDROBENZO[F]QUINOLIN-3-ONES SMITHKLINE BEECHAM CORPORATION (US) 1995-03-02 WO claimed
EP-0724440-A4 DI- AND TETRA-HYDROBENZO F]QUINOLIN-3-ONES SMITHKLINE BEECHAM CORP (US) 1996-11-20 EP disclosed
EP-0724440-A1 DI- AND TETRA-HYDROBENZO F]QUINOLIN-3-ONES SMITHKLINE BEECHAM CORPORATION (US) 1996-08-07 EP disclosed
WO-1995005821-A1 DI- AND TETRA-HYDROBENZO[F]QUINOLIN-3-ONES SMITHKLINE BEECHAM CORPORATION (US) 1995-03-02 WO disclosed