SCHEMBL10573201

SCHEMBL10573201

CCOc1ccccc1N1CCN(CCCOc2ccc3c(c2)NC(=O)CC3)CC1

nearest known ligand 0.95

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.95
DRD3 P35462 9/20 0.84
DRD4 P21917 8/20 0.84

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
SCHEMBL8078 0.97 DRD2 (1.00) DRD2DRD3DRD4
SCHEMBL250675 0.94 DRD2 (1.00) DRD2DRD3DRD4
SCHEMBL10570451 0.92 DRD2 (1.00) DRD2DRD3DRD4
SCHEMBL252295 0.89 DRD2 (1.00) DRD2DRD3DRD4
SCHEMBL10574132 0.88 DRD2 (0.95) DRD2DRD3DRD4
SCHEMBL14974690 0.88 DRD2 (1.00) DRD2DRD3DRD4
SCHEMBL3157625 0.87 DRD2 (0.81) DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL3153054 0.87 DRD2 (0.80) DRD2DRD3DRD4
SCHEMBL3163009 0.87 DRD2 (0.80) DRD2DRD3DRD4
SCHEMBL10571409 0.87 DRD2 (0.94) DRD2DRD3DRD4

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-4734416-A ANTIHISTAMINES, CENTRAL NERVOUS SYSTEM CONTROLLING ACTION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-03-29 US claimed
US-4824840-A ANTIHISTAMINES, NERVOUS SYSTEM CONTROLLERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-04-25 US disclosed
US-4734416-A ANTIHISTAMINES, CENTRAL NERVOUS SYSTEM CONTROLLING ACTION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-03-29 US disclosed