SCHEMBL9027543

SCHEMBL9027543

CC(=O)Nc1ccccc1N1CCN(CCCNc2ccc(C)cc2C(=O)N(C)C)CC1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 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
Hydrochloric Acid SCHEMBL9028181 0.99 DRD2 (0.48) DRD2
SCHEMBL9028135 0.89 DRD2 (0.50) DRD2
Hydrochloric Acid SCHEMBL9027301 0.89 DRD2 (0.46) DRD2
Hydrochloric Acid SCHEMBL9027010 0.88 DRD2 (0.47) DRD2
Hydrochloric Acid SCHEMBL9028286 0.85 DRD2 (0.61) DRD2
SCHEMBL9026064 0.84 MAPK1 (0.48) DRD2
Hydrochloric Acid SCHEMBL9027012 0.83 MAPK1 (0.47) DRD2
Hydrochloric Acid SCHEMBL9026528 0.81 — —
SCHEMBL8828736 0.79 TSHR (0.41) —
Hydrochloric Acid SCHEMBL8828706 0.78 TSHR (0.40) —

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-0711757-A1 3-(4-phenylpiperazin-1-yl)propyl-amino, thio and oxy -pyridine, pyrimidine and benzene derivatives as alpha1-adrenoceptor antagonists F. Hoffmann-La Roche AG (CH) 1996-05-15 — — EP disclosed
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