SCHEMBL6161934

SCHEMBL6161934

COc1ccccc1OCC1CN(Cc2ccc(C(F)(F)F)cc2)CCO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 20/20 1.00
▸ DRD2 P14416 1/20 0.63

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
Oxalic Acid SCHEMBL6164503 0.94 DRD4 (0.89) DRD4DRD2
SCHEMBL6160027 0.87 DRD4 (1.00) DRD4DRD2
SCHEMBL6161766 0.84 DRD4 (1.00) DRD4DRD2
Oxalic Acid SCHEMBL7648434 0.83 DRD4 (0.89) DRD4DRD2
Oxalic Acid SCHEMBL6165259 0.82 DRD4 (0.88) DRD4DRD2
SCHEMBL6160762 0.81 DRD4 (1.00) DRD4DRD2
Oxalic Acid SCHEMBL6163601 0.79 DRD4 (0.89) DRD4DRD2
SCHEMBL25396399 0.79 DRD4 (0.85) DRD4
SCHEMBL6162328 0.79 DRD4 (0.85) DRD4
SCHEMBL6164051 0.78 DRD4 (1.00) DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920423-B1 DISUBSTITUTED MORPHOLINE, OXAZEPINE OR THIAZEPINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS DOPAMINE D4 RECEPTOR ANTAGONISTS NEUROSEARCH AS (DK) 2005-01-26 — — EP claimed
EP-0920423-B1 DISUBSTITUTED MORPHOLINE, OXAZEPINE OR THIAZEPINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS DOPAMINE D4 RECEPTOR ANTAGONISTS NEUROSEARCH AS (DK) 2005-01-26 — — EP disclosed
US-6479491-B1 USEFUL IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, ESPECIALLY PSYCHOTIC DISORDERS SUCH AS SCHIZOPHRENIA NEUROSEARCH A/S (DK) 2002-11-12 — — US disclosed
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