SCHEMBL7450768

SCHEMBL7450768

CC(C)(C)c1nc(N2CCN(CCCO)CC2)cc(C(F)(F)F)n1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.67
DRD3 P35462 20/20 0.67

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
SCHEMBL7257880 0.91 DRD2 (0.57) DRD2DRD3
SCHEMBL392268 0.88 DRD2 (0.66) DRD2DRD3
SCHEMBL4767228 0.88 DRD2 (0.66) DRD2DRD3
SCHEMBL8205951 0.88 DRD2 (0.66) DRD2DRD3
SCHEMBL2347632 0.87 DRD2 (0.67) DRD2DRD3
Hydrochloric Acid SCHEMBL2347036 0.87 DRD2 (0.64) DRD2DRD3
SCHEMBL2232549 0.86 DRD2 (0.67) DRD2DRD3
SCHEMBL6600239 0.84 DRD2 (0.66) DRD2DRD3
SCHEMBL6601712 0.83 DRD2 (0.68) DRD2DRD3
SCHEMBL16463974 0.81 DRD2 (1.00) DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472392-B1 Triazole compounds and the use thereof as dopamine-D3 -ligands ABBOTT LABORATORIES 2002-10-29 US disclosed
EP-0994865-B1 TRIAZOLE COMPOUNDS AND THE USE THEREOF AS DOPAMINE-D 3-LIGANDS BASF AG (DE) 2002-03-06 EP disclosed