SCHEMBL24312876

SCHEMBL24312876

NCCCN1CCc2ccc(OCCCN3CCN(c4cccc5sccc45)CC3)cc2C1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.65

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
SCHEMBL5504467 0.89 DRD2 (0.72) DRD2
Hydrochloric Acid SCHEMBL5512064 0.85 DRD2 (0.67) DRD2
SCHEMBL22769209 0.84 DRD2 (0.78) DRD2
SCHEMBL1039550 0.82 DRD2 (0.71) DRD2
SCHEMBL5508049 0.80 DRD2 (0.71) DRD2
SCHEMBL5506829 0.80 DRD2 (0.63) DRD2
Hydrochloric Acid SCHEMBL293576 0.79 DRD2 (0.75) DRD2
SCHEMBL28495089 0.79 DRD2 (0.64) DRD2
SCHEMBL1038733 0.79 DRD2 (0.87) DRD2
SCHEMBL1037298 0.79 DRD2 (1.00) DRD2

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
EP-3981772-A1 TETRA-FUNCTIONAL CHEMICAL PROBE AND METHOD FOR IDENTIFYING TARGET MEMBRANE PROTEIN FROM LIVING CELL OR LIVING TISSUE BY USING SAID PROBE Otsuka Pharmaceutical Co., Ltd. (JP) 2022-04-13 EP disclosed