SCHEMBL6581749

SCHEMBL6581749

O=C1CC2(CCCC2)CC(=O)N1CCN1CCN(c2cc(F)ccc2Cl)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA1B P35368 17/20 1.00
HTR1A P08908 17/20 1.00
ADRA1A P35348 9/20 1.00
ADRA1D P25100 5/20 0.80
DRD2 P14416 3/20 0.80

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
SCHEMBL6752801 0.89 HTR1A (1.00) ADRA1BHTR1AADRA1AADRA1DDRD2
SCHEMBL6582012 0.89 ADRA1B (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6582852 0.88 ADRA1B (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6577718 0.88 ADRA1B (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6582295 0.87 HTR1A (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6580540 0.87 HTR1A (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6577740 0.86 ADRA1B (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6577688 0.83 ADRA1B (1.00) ADRA1BHTR1AADRA1AADRA1D
SCHEMBL6752779 0.80 HTR1A (1.00) ADRA1BHTR1AADRA1AADRA1DDRD2
SCHEMBL6751064 0.79 HTR1A (1.00) ADRA1BHTR1AADRA1AADRA1DDRD2

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-1200406-B1 CYCLIC AMIDES AND IMIDES HAVING SELECTIVE ANTAGONIST ACTIVITY AT ALPHA-1D ADRENERGIC RECEPTOR RECORDATI CHEM PHARM (IT) 2004-11-24 EP claimed
EP-1200406-B1 CYCLIC AMIDES AND IMIDES HAVING SELECTIVE ANTAGONIST ACTIVITY AT ALPHA-1D ADRENERGIC RECEPTOR RECORDATI CHEM PHARM (IT) 2004-11-24 EP disclosed