SCHEMBL8917481

SCHEMBL8917481

CCCN1CCOC(c2cccs2)C1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.54
DRD2 P14416 3/20 0.39
HTT P42858 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38
DRD1 P21728 1/20 0.38
DRD4 P21917 1/20 0.38
DRD5 P21918 1/20 0.38

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
SCHEMBL7017151 0.84 DRD3 (0.38) DRD3DRD2HTTKDM4ETSHR
SCHEMBL22653556 0.80 KDM4E (0.42) DRD3HTTKDM4ETSHR
SCHEMBL30100998 0.80 CNR2 (0.53) DRD3DRD2DRD4
SCHEMBL4250430 0.80 DRD3 (0.51) DRD3DRD2
SCHEMBL2936540 0.77 DRD3 (0.71) DRD3DRD2DRD1DRD4DRD5
SCHEMBL4239212 0.73 DRD3 (0.50) DRD3DRD2DRD1DRD4DRD5
SCHEMBL12947908 0.72 DRD3 (0.63) DRD3DRD2
SCHEMBL4239047 0.72 DRD3 (0.49) DRD3DRD2DRD4
SCHEMBL18110505 0.71 SMN1; SMN2 (0.39) HTTKDM4ETSHR
SCHEMBL969955 0.71 DRD3 (0.74) DRD3DRD2

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
JP-9118848-A None JP disclosed
JP-H09118848-A ULTRAVIOLET-CURABLE INK, HEAT TRANSFER LABEL AND THEIR PRODUCTION ILLINOIS TOOL WORKS INC <ITW> 1997-05-06 JP disclosed