SCHEMBL9368652

SCHEMBL9368652

Fc1ccc2c(c1)C(CCCCN1CCN(c3cccc4c3OCCO4)CC1)CN2

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.56
HTR1A P08908 3/20 0.54

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
SCHEMBL6592195 0.94 DRD2 (0.54) DRD2HTR1A
SCHEMBL9373232 0.89 DRD2 (0.56) DRD2HTR1A
SCHEMBL9368508 0.89 HTR1A (0.59) HTR1A
SCHEMBL9373720 0.88 DRD2 (0.46) DRD2HTR1A
SCHEMBL6588462 0.82 DRD2 (0.54) DRD2
SCHEMBL6591927 0.82
SCHEMBL9367716 0.79 LMNA (0.58) DRD2HTR1A
SCHEMBL6589732 0.79 DRD2 (0.54) DRD2
Oxalic Acid SCHEMBL6778343 0.78 DRD2 (0.49) DRD2HTR1A
SCHEMBL9180759 0.77 HTR1A (0.63) HTR1A

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-0376607-B1 Piperazinyl derivatives LUNDBECK & CO AS H (DK) 1994-03-02 EP disclosed
US-5002948-A Central Nervous System Disorders H. LUNDBECK A/S (DK) 1991-03-26 US disclosed
EP-0376607-A1 Piperazinyl derivatives H. LUNDBECK A/S (DK) 1990-07-04 EP disclosed