SCHEMBL31583545

SCHEMBL31583545

Clc1cccc(-c2n[nH]c(C3CCN(CCc4ccccc4)CC3)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 10/20 0.55
DRD2 P14416 10/20 0.55
USP30 Q70CQ3 2/20 0.54
DRD3 P35462 7/20 0.51
SIGMAR1 Q99720 1/20 0.49
PRCP P42785 4/20 0.48
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
TSHR P16473 1/20 0.46
TLR9 Q9NR96 2/20 0.45
TLR8 Q9NR97 2/20 0.45
TLR7 Q9NYK1 2/20 0.45
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL31583600 0.94 DRD4 (0.53) DRD4DRD2USP30DRD3SIGMAR1
SCHEMBL31583234 0.84 DRD2 (0.55) DRD4DRD2USP30DRD3ALDH1A1
SCHEMBL31583291 0.83 USP30 (0.49) DRD4DRD2USP30TLR9TLR8
SCHEMBL31583118 0.80 USP30 (0.48) DRD4DRD2USP30DRD3ALDH1A1
SCHEMBL19385365 0.78 USP30 (0.72) DRD4DRD2USP30DRD3TLR9
SCHEMBL31583603 0.77 DRD4 (0.57) DRD4DRD2DRD3PRCPALDH1A1
SCHEMBL10070543 0.76 GABRA1 (0.45) USP30TLR9TLR8TLR7
Hydrochloric Acid SCHEMBL31583248 0.75 GABRA1 (0.44) USP30TLR9TLR8TLR7
SCHEMBL7948282 0.73 HTR2A (0.80) DRD4DRD2DRD3SIGMAR1HTR2A
SCHEMBL14486677 0.72 SIGMAR1 (0.57) DRD4DRD2DRD3SIGMAR1

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-2025104092-A1 MODULATORS OF SEPTIN 6 FOR USE IN THE PREVENTION AND/OR TREATMENT OF NEURODEGENERATIVE DISORDERS REMYND N.V. (BE) 2025-05-22 WO disclosed