SCHEMBL1388669

SCHEMBL1388669

Cn1nc(C2CCN(Cc3ccc(Cl)cc3)CC2)cc1-c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 11/20 0.58
▸ DRD4 P21917 11/20 0.58
▸ DRD3 P35462 10/20 0.58
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ PRCP P42785 2/20 0.48
▸ LSS P48449 1/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.42

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
SCHEMBL14687101 0.85 PRCP (0.67) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL1388434 0.81 DRD4 (0.60) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL12185982 0.76 PRCP (0.68) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL12185527 0.74 PRCP (0.70) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL12186005 0.74 PRCP (0.74) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL1388442 0.73 DRD2 (1.00) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL1388750 0.73 DRD2 (0.66) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL1388461 0.72 DRD2 (1.00) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL1388605 0.71 DRD2 (0.60) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL12185551 0.71 PRCP (0.73) DRD2DRD4DRD3MEN1KMT2A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665833-B1 DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME (GB) 1999-07-14 — — EP claimed
EP-0822814-A4 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1998-12-09 — — EP claimed
EP-0822814-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 1998-02-11 — — EP claimed
WO-1996032938-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1996-10-24 — — WO claimed
JP-H08502508-A — — 1996-03-19 — — JP claimed
WO-1994010145-A1 DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LIMITED (GB) 1994-05-11 — — WO claimed
EP-0665833-B1 DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME (GB) 1999-07-14 — — EP disclosed
US-5668148-A BENIGN PROSTATIC HYPERTROPHY MERCK & CO., INC. (US) 1997-09-16 — — US disclosed
US-5631269-A Dopamine receptor subtype ligands MERCK SHARP & DOHME LIMITED (GB) 1997-05-20 — — US disclosed
EP-0665833-A1 DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LTD. (GB) 1995-08-09 — — EP disclosed
WO-1994010145-A1 DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LIMITED (GB) 1994-05-11 — — WO disclosed
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