SCHEMBL7252879

SCHEMBL7252879

COc1ccnc(OCCCN2CCN(c3cc(C(F)(F)F)nc(C(C)(C)C)n3)CC2)n1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.58
DRD3 P35462 20/20 0.58

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
SCHEMBL7251876 0.88 DRD3 (0.56) DRD2DRD3
SCHEMBL5899239 0.88 DRD2 (0.59) DRD2DRD3
SCHEMBL7252084 0.85 DRD3 (0.57) DRD2DRD3
SCHEMBL6600963 0.85 DRD2 (0.53) DRD2DRD3
SCHEMBL7255815 0.81 DRD2 (0.49) DRD2DRD3
SCHEMBL7252658 0.81 DRD2 (0.50) DRD2DRD3
SCHEMBL392268 0.79 DRD2 (0.66) DRD2DRD3
SCHEMBL7252411 0.79 DRD2 (0.60) DRD2DRD3
SCHEMBL7255730 0.78 DRD2 (0.58) DRD2DRD3
SCHEMBL2232549 0.78 DRD2 (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003002543-A1 PYRIMIDINOXYALKYLPIPERAZINES AND THEIR THERAPEUTIC USE ABBOTT LABORATORIES (US) 2003-01-09 WO disclosed