SCHEMBL7362689

SCHEMBL7362689

N#Cc1ccc(OCC2CCN(CC3CC3)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 1.00

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
SCHEMBL20766385 0.85 SIGMAR1 (0.73) SIGMAR1
SCHEMBL5207819 0.84 HRH3 (0.74) SIGMAR1
SCHEMBL7364335 0.83 SIGMAR1 (0.71) SIGMAR1
SCHEMBL7362469 0.83 SIGMAR1 (0.71) SIGMAR1
SCHEMBL7435081 0.82 SIGMAR1 (0.70) SIGMAR1
SCHEMBL16208844 0.82 SIGMAR1 (0.85) SIGMAR1
Hydrochloric Acid SCHEMBL7356651 0.82 SIGMAR1 (0.69) SIGMAR1
SCHEMBL30018352 0.80 SIGMAR1 (1.00) SIGMAR1
SCHEMBL3913603 0.80 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9340244 0.79 SIGMAR1 (0.66) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5296479-A Treating physiological or drug-induced psychosis or dyskinesia THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-03-22 US disclosed
US-5266572-A Antipsychotic 1-cycloalkylpiperidines THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-11-30 US disclosed
US-5243048-A Treatment of drug-induced or physiological psychosis or dyskinesia; side effect reduction THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-09-07 US disclosed
EP-0490962-A4 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES 1993-03-03 EP disclosed
EP-0490962-A1 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-06-24 EP disclosed
US-5109002-A ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-04-28 US disclosed
WO-1991003243-A1 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-03-21 WO disclosed