SCHEMBL10513397

SCHEMBL10513397

O=C1CCCN1CCN1CCN(c2cccc3ccoc23)CC1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRA1B P35368 3/20 0.63
ADRA1D P25100 2/20 0.63
ADRA1A P35348 2/20 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
Hydrochloric Acid SCHEMBL10513723 0.99 ADRA1B (0.62) ADRA1BADRA1DADRA1A
SCHEMBL10514152 0.84 HTR1A (0.56)
SCHEMBL9306135 0.81 ADRA1D (0.66) ADRA1BADRA1DADRA1A
SCHEMBL10514665 0.79
SCHEMBL8142907 0.78 DRD2 (0.55)
SCHEMBL10524008 0.77
SCHEMBL10515450 0.77
SCHEMBL10513645 0.75
SCHEMBL10514687 0.75
SCHEMBL10519236 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0190472-B1 NEW PHARMACEUTICAL COMPOSITIONS HAVING ANTI-PSYCHOTIC PROPERTIES DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1989-07-12 EP claimed
EP-0190472-A1 New pharmaceutical compositions having anti-psychotic properties DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1986-08-13 EP claimed
EP-0190472-B1 NEW PHARMACEUTICAL COMPOSITIONS HAVING ANTI-PSYCHOTIC PROPERTIES DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1989-07-12 EP disclosed
US-4782061-A CENTRAL NERVOUS SYSTEM DISORDERS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1988-11-01 US disclosed
EP-0190472-A1 New pharmaceutical compositions having anti-psychotic properties DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1986-08-13 EP disclosed