SCHEMBL8877017

SCHEMBL8877017

CN1CCC(C2(O)c3ccc(Cl)cc3CC(=O)c3cccnc32)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
DRD4 P21917 5/20 0.39
DRD2 P14416 3/20 0.39
HTR2A P28223 3/20 0.39
FNTA P49354 6/20 0.36
FNTB P49356 6/20 0.36
HRH1 P35367 1/20 0.36
ADRA2A P08913 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
F2 P00734 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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 0.83 MAPK1 (0.53) MAPK1SMN1; SMN2DRD4DRD2FNTA
SCHEMBL32668926 0.83 MAPK1 (0.53) MAPK1SMN1; SMN2DRD4DRD2FNTA
SCHEMBL8878095 0.79 DRD4 (0.39) MAPK1SMN1; SMN2DRD4DRD2HTR2A
SCHEMBL8876923 0.78 FNTA (0.43) MAPK1SMN1; SMN2DRD4DRD2HTR2A
SCHEMBL7000885 0.76 FNTA (0.45) MAPK1SMN1; SMN2DRD4DRD2HTR2A
SCHEMBL9215850 0.75 DRD2 (0.41) MAPK1SMN1; SMN2DRD4DRD2HTR2A
SCHEMBL5475539 0.72 HRH1 (0.54) MAPK1SMN1; SMN2HTR2AFNTAFNTB
SCHEMBL8709456 0.71 MAPK1 (0.72) MAPK1SMN1; SMN2DRD2HTR2AHRH1
SCHEMBL9215632 0.71 HTR2A (0.36) MAPK1SMN1; SMN2DRD4DRD2HTR2A
SCHEMBL9832235 0.70 MAPK1 (0.53) MAPK1SMN1; SMN2DRD4DRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5665726-A ANTIALLERGIC, ANTIINFLAMMATORY AGENTS SCHERING CORPORATION (US) 1997-09-09 US disclosed
EP-0685476-A1 Benzo(5,6)cycloheptapyridines, compositions and methods of use SCHERING CORPORATION (US) 1995-12-06 EP disclosed
US-5438062-A Antiallergens, antiinflammatory agents SCHERING CORPORATION (US) 1995-08-01 US disclosed
EP-0270818-B1 Benzo(5,6)cycloheptapyridines, compositions and method of use SCHERING CORP (US) 1994-12-28 EP disclosed
EP-0288640-B1 6,11-Dihydro-11-(4-piperidylidene)-5H-benzo[5,6]cyclohepta-[1,2-b]pyridines and compositions and methods of use SCHERING CORPORATION (US) 1992-09-09 EP disclosed
US-5089496-A Benzo[5,6]cycloheptapyridine compounds, compositions and method of treating allergies SCHERING CORPORATION (US) 1992-02-18 US disclosed
EP-0330673-A1 BENZO 5,6]CYCLOHEPTAPYRIDINES, COMPOSITIONS AND METHODS OF USE SCHERING CORPORATION (US) 1989-09-06 EP disclosed
US-4804666-A ANTIHISTAMINES SCHERING CORPORATION (US) 1989-02-14 US disclosed
EP-0288640-A1 6,11-Dihydro-11-(4-piperidylidene)-5H-benzo[5,6]cyclohepta-[1,2-b]pyridines and compositions and methods of use SCHERING CORPORATION (US) 1988-11-02 EP disclosed
EP-0270818-A1 Benzo(5,6)cycloheptapyridines, compositions and method of use SCHERING CORPORATION (US) 1988-06-15 EP disclosed
WO-1988003138-A1 BENZO[5,6]CYCLOHEPTAPYRIDINES, COMPOSITIONS AND METHODS OF USE SCHERING CORPORATION (US) 1988-05-05 WO disclosed