SCHEMBL11066967

SCHEMBL11066967

CC(COc1cccc2c1CCC(=O)N2)CN1CCC(c2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.55
SCN5A Q14524 3/20 0.55
SCN9A Q15858 3/20 0.55
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
OPRK1 P41145 1/20 0.47
DRD4 P21917 1/20 0.45
KCNH2 Q12809 2/20 0.42
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC18A3 Q16572 2/20 0.40
PARP1 P09874 1/20 0.39
SIGMAR1 Q99720 2/20 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
SCHEMBL11061316 0.89 SCN5A (0.69) SCN1ASCN5ASCN9AADRB2ADRB1
SCHEMBL11071304 0.87 DRD4 (0.62) SCN1ASCN5ASCN9AADRB2ADRB1
SCHEMBL10572684 0.84 SCN5A (0.54) SCN1ASCN5ASCN9AADRB2ADRB1
SCHEMBL11073435 0.82 HTR7 (0.48) SCN1ASCN5ASCN9ADRD4TSHR
Hydrochloric Acid SCHEMBL11070539 0.81 HTR7 (0.47) SCN1ASCN5ASCN9ADRD4SIGMAR1
SCHEMBL10666537 0.81 SCN1A (0.51) SCN1ASCN5ASCN9AADRB2ADRB1
SCHEMBL11071272 0.81 DRD4 (0.45) DRD4KCNH2TSHRL3MBTL1SLC18A3
SCHEMBL11066783 0.79 SLC18A3 (0.38) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL11066964 0.77 SCN1A (0.41) SCN1ASCN5ASCN9AADRB2ADRB1
SCHEMBL11070047 0.77 DRD2 (0.51) SCN1ASCN5ASCN9AHTR1APARP1

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
US-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed