SCHEMBL9215632

SCHEMBL9215632

CN1CCC(C23OC(O)(Cc4cc(Cl)ccc42)c2cccnc23)CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
FNTA P49354 7/20 0.36
FNTB P49356 7/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 1/20 0.36
AVPR1A P37288 3/20 0.35
SLC6A3 Q01959 2/20 0.33
P2RX7 Q99572 1/20 0.33
SSTR4 P31391 1/20 0.33
LMNA P02545 1/20 0.33
F2 P00734 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
SCHEMBL4457894 0.74 MAPK1 (0.53) DRD2DRD4FNTAFNTBSMN1; SMN2
SCHEMBL32668926 0.74 MAPK1 (0.53) DRD2DRD4FNTAFNTBSMN1; SMN2
SCHEMBL8876923 0.71 FNTA (0.43) HTR2ADRD2DRD4FNTAFNTB
SCHEMBL8877017 0.71 MAPK1 (0.41) HTR2ADRD2DRD4FNTAFNTB
SCHEMBL8786099 0.70 FNTA (0.42) DRD2DRD4FNTAFNTBSMN1; SMN2
SCHEMBL7000885 0.69 FNTA (0.45) HTR2ADRD2DRD4FNTAFNTB
SCHEMBL14430439 0.68 MAPK1 (0.40) DRD2DRD4SMN1; SMN2MAPK1SLC6A3
SCHEMBL8878095 0.67 DRD4 (0.39) HTR2ADRD2DRD4FNTAFNTB
SCHEMBL9215850 0.67 DRD2 (0.41) HTR2ADRD2DRD4FNTAFNTB
SCHEMBL8709456 0.63 MAPK1 (0.72) HTR2ADRD2SMN1; SMN2MAPK1SSTR4

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-0535152-B1 Bis-benzo or benzopyrido cyclo hepta piperidene, piperidylene and piperazine compounds as PAF antagonists and compositions thereof. SCHERING CORP (US) 1995-08-09 EP disclosed
US-5422351-A Antiallergens; antiinflammatory agents SCHERING CORPORATION (US) 1995-06-06 US disclosed
EP-0396083-B1 Heterocyclic N-oxide derivatives of substituted benzo[5,6]cycloheptapyridines, compositions and methods of use SCHERING CORP (US) 1994-11-30 EP disclosed
EP-0535152-A1 BIS-BENZO OR BENZOPYRIDO CYCLO HEPTA PIPERIDENE, PIPERIDYLIDENE AND PIPERAZINE COMPOUNDS AND COMPOSITIONS. SCHERING CORP (US) 1993-04-07 EP disclosed
US-5151423-A Antiinflammatory agents or antiallergens SCHERING CORPORATION (US) 1992-09-29 US disclosed
EP-0471750-A1 HETEROCYCLIC N-OXIDE DERIVATIVES OF SUBSTITUTED BENZO 5,6]CYCLOHEPTAPYRIDINES, COMPOSITIONS AND METHODS OF USE SCHERING CORPORATION (US) 1992-02-26 EP disclosed
WO-1992000293-A1 BIS-BENZO OR BENZOPYRIDO CYCLO HEPTA PIPERIDENE, PIPERIDYLIDENE AND PIPERAZINE COMPOUNDS AND COMPOSITIONS SCHERING CORPORATION (US) 1992-01-09 WO disclosed
WO-1990013548-A1 HETEROCYCLIC N-OXIDE DERIVATIVES OF SUBSTITUTED BENZO[5,6]CYCLOHEPTAPYRIDINES, COMPOSITIONS AND METHODS OF USE SCHERING CORPORATION (US) 1990-11-15 WO disclosed
EP-0396083-A1 Heterocyclic N-oxide derivatives of substituted benzo[5,6]cycloheptapyridines, compositions and methods of use SCHERING CORPORATION (US) 1990-11-07 EP disclosed