SCHEMBL9027526

SCHEMBL9027526

COc1cc(Br)ccc1N1CCN(CCCNc2ncccc2C(=O)N(C)C)CC1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.64

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 SCHEMBL9028127 0.99 DRD2 (0.63) DRD2
Hydrochloric Acid SCHEMBL9028188 0.91 DRD2 (0.65) DRD2
SCHEMBL9027775 0.91 — —
Hydrochloric Acid SCHEMBL9028483 0.90 DRD2 (0.64) DRD2
Hydrochloric Acid SCHEMBL9027388 0.89 — —
SCHEMBL9027734 0.89 ADRA1D (0.75) —
Oxalic Acid SCHEMBL8828479 0.89 DRD2 (0.65) DRD2
Hydrochloric Acid SCHEMBL9026670 0.88 ADRA1D (0.74) —
SCHEMBL9027001 0.88 — —
Hydrochloric Acid SCHEMBL9028401 0.87 — —

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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