SCHEMBL8559977

SCHEMBL8559977

O=C1c2ccccc2C(=O)N1CCCCCCCCBr.O=C1c2ccccc2C(=O)N1CCCCCCCCN1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.60
MAOB P27338 3/20 0.59
DRD2 P14416 1/20 0.56
DRD3 P35462 1/20 0.56

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
SCHEMBL8557594 0.99 HTR1A (0.62) HTR1AMAOB
SCHEMBL8554502 0.93 HTR1A (0.68) HTR1AMAOB
SCHEMBL3174057 0.91 HTR1A (0.68) HTR1AMAOBDRD2DRD3
SCHEMBL2687983 0.91 HTR1A (0.70) HTR1AMAOB
SCHEMBL8557005 0.91 HTR1A (0.70) HTR1AMAOB
SCHEMBL12124720 0.91 HTR1A (0.68) HTR1AMAOBDRD2DRD3
SCHEMBL6339624 0.89 HTR1A (0.69) HTR1AMAOBDRD2DRD3
SCHEMBL2362765 0.88 HTR1A (0.68) HTR1AMAOBDRD2DRD3
SCHEMBL5824979 0.88 HTR1A (0.68) HTR1AMAOBDRD2DRD3
SCHEMBL1569172 0.86 HTR1A (0.69) HTR1AMAOBDRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0575954-B1 Aminoalkylcarbamic esters of eseroline suitable for use as cholinesterase acitivity inhibitors and relative preparation process MEDIOLANUM FARMACEUTICI SRL (IT) 1998-09-02 EP disclosed
US-5424451-A Used as cholinesterase activity inhibitors MEDIOLANUM FARMACEUTICI S.P.A. (IT) 1995-06-13 US disclosed