SCHEMBL28481587

SCHEMBL28481587

N#Cc1ccc2[nH]cc(CC=CCCl)c2c1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 11/20 0.52
▸ DRD2 P14416 5/20 0.47
▸ DRD4 P21917 5/20 0.47
▸ DRD3 P35462 5/20 0.47

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
SCHEMBL18011073 0.81 SLC6A4 (0.56) SLC6A4DRD2DRD4DRD3
SCHEMBL6108317 0.80 SLC6A4 (0.64) SLC6A4DRD2DRD4DRD3
SCHEMBL29005985 0.79 SLC6A4 (0.62) SLC6A4DRD2DRD4DRD3
SCHEMBL6879916 0.77 SLC6A4 (0.69) SLC6A4
SCHEMBL30468389 0.77 SLC6A4 (0.69) SLC6A4
SCHEMBL2531600 0.77 SLC6A4 (0.64) SLC6A4DRD3
SCHEMBL24688682 0.76 SLC6A4 (0.59) SLC6A4DRD2DRD4DRD3
SCHEMBL13226846 0.76 SLC6A4 (0.63) SLC6A4DRD2DRD4DRD3
SCHEMBL24328228 0.76 SLC6A4 (0.59) SLC6A4DRD2DRD4DRD3
SCHEMBL29985571 0.76 SLC6A4 (0.59) SLC6A4DRD2DRD4DRD3

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
CN-107501159-B Synthesis method of vilazodone intermediate 3- (4-chlorobutyl) -5-cyanoindole 连云港恒运药业有限公司 2020-11-24 — — CN disclosed
CN-107501159-B Synthesis method of vilazodone intermediate 3- (4-chlorobutyl) -5-cyanoindole 连云港恒运药业有限公司 2020-11-24 — — CN disclosed
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