SCHEMBL11303471

SCHEMBL11303471

O=C1CCc2c(cccc2OCCCN2CCN(c3ccccc3O)CC2)N1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 13/20 0.55
▸ DRD4 P21917 8/20 0.54
▸ DRD3 P35462 8/20 0.54
▸ SCN1A P35498 1/20 0.49
▸ SCN5A Q14524 1/20 0.49
▸ SCN9A Q15858 1/20 0.49

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
SCHEMBL10662890 0.88 DRD2 (0.62) DRD2DRD4DRD3
SCHEMBL10572205 0.88 DRD2 (0.69) DRD2DRD4DRD3
SCHEMBL10569129 0.87 DRD2 (0.66) DRD2DRD4DRD3
SCHEMBL10570148 0.85 DRD2 (0.59) DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL10569951 0.85 DRD2 (0.58) DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL10569016 0.85 DRD2 (0.58) DRD2DRD4DRD3
SCHEMBL10573269 0.84 DRD2 (0.48) DRD2DRD4DRD3
SCHEMBL11307197 0.82 HTR7 (0.67) DRD2DRD4DRD3
SCHEMBL10570868 0.82 DRD2 (0.56) DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL11406538 0.82 DRD2 (0.50) DRD2DRD4DRD3

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-56049361-A — — None — — JP disclosed
JP-S5649361-A CARBOSTYRIL DERIVATIVE OTSUKA PHARMACEUT CO LTD 1981-05-02 — — JP disclosed
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