SCHEMBL8964198

SCHEMBL8964198

CCCC(c1ccc(F)cc1)(c1ccc(F)cc1)N1CCN(Cc2nc(-c3ccccc3)[nH]c2C)CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.53
DRD4 P21917 1/20 0.53
DRD3 P35462 1/20 0.53
CTSS P25774 17/20 0.46
GNRHR P30968 1/20 0.41

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
SCHEMBL8963744 0.75 DRD2 (0.71) DRD2DRD4DRD3CTSS
SCHEMBL8964019 0.75 DRD2 (0.71) DRD2DRD4DRD3CTSS
SCHEMBL8964201 0.74 DRD3 (0.55) DRD2DRD4DRD3CTSS
SCHEMBL8834289 0.70 DRD4 (1.00) DRD2DRD4DRD3CTSS
SCHEMBL8963668 0.70 DRD2 (0.64) DRD2DRD4DRD3CTSS
SCHEMBL8964204 0.70 SLC6A2 (0.34) DRD2DRD4DRD3
SCHEMBL8963868 0.69 DRD2 (0.63) DRD2DRD4DRD3CTSS
SCHEMBL9720664 0.69 DRD2 (0.62) DRD2DRD4DRD3CTSSGNRHR
SCHEMBL8963465 0.69 LMNA (0.57) DRD2DRD4DRD3CTSSGNRHR
SCHEMBL8963624 0.68 DRD2 (0.47) DRD2DRD4DRD3CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5514800-A CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA SYNTEX PHARMACEUTICALS, LTD. (GB) 1996-05-07 US disclosed