SCHEMBL9256276

SCHEMBL9256276

O=C1c2ccccc2C(=O)N1CCCCN1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.81
DRD3 P35462 4/20 0.81
MAOB P27338 4/20 0.64
ADRA1A P35348 1/20 0.59
ADRA1B P35368 1/20 0.59
HTR1A P08908 4/20 0.57
ACHE P22303 3/20 0.57

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
SCHEMBL9256958 0.99 DRD2 (0.79) DRD2DRD3MAOBADRA1AADRA1B
SCHEMBL9258386 0.97 DRD2 (0.77) DRD2DRD3MAOBADRA1AADRA1B
SCHEMBL9250065 0.92 DRD2 (0.68) DRD2DRD3MAOBADRA1AADRA1B
SCHEMBL9256633 0.90 DRD2 (1.00) DRD2DRD3MAOBHTR1A
SCHEMBL7976323 0.87 DRD2 (0.95) DRD2DRD3MAOBHTR1A
Hydrochloric Acid SCHEMBL10826808 0.86 DRD2 (0.92) DRD2DRD3MAOBADRA1BHTR1A
SCHEMBL6777166 0.83 DRD2 (0.57) DRD2DRD3MAOBACHE
SCHEMBL9360236 0.83 ADRA1B (0.70) DRD2DRD3ADRA1AADRA1BHTR1A
SCHEMBL10763449 0.82 DRD2 (0.95) DRD2DRD3MAOBADRA1BHTR1A
SCHEMBL9733689 0.81 DRD2 (0.84) DRD2DRD3MAOBHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5470851-A Antihistamine, anticoagulants SANKYO COMPANY, LIMITED (JP) 1995-11-28 US disclosed
US-5084496-A Impact resistant thermoplastic molding material GE PLASTICS JAPAN, LTD. (JP) 1992-01-28 US disclosed
EP-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 EP disclosed