SCHEMBL21592322

SCHEMBL21592322

CCC(C)CCN1CCOC(I)C1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 7/20 0.34

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
SCHEMBL21592377 0.86 DRD3 (0.33) DRD3
SCHEMBL12331476 0.77
SCHEMBL12331473 0.76 KEAP1 (0.42)
SCHEMBL24483402 0.76 ALDH1A1 (0.42)
SCHEMBL7266000 0.76 ALDH1A1 (0.42)
SCHEMBL12331482 0.75 DRD3 (0.33) DRD3
SCHEMBL12331031 0.74 HRH3 (0.33) DRD3
SCHEMBL12331468 0.74 KDM4E (0.45) DRD3
SCHEMBL12331481 0.74 DRD3 (0.32) DRD3
SCHEMBL12331472 0.74 GBA1 (0.36) DRD3

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-2019238886-A1 BIFUNCTIONAL MOLECULES FOR TARGETING USP14 UNIVERSITY OF DUNDEE (GB) 2019-12-19 WO disclosed