SCHEMBL5887997

SCHEMBL5887997

CC(C)C(=O)Nc1ccc(F)c(C2CCN(CCCNC(=O)C3(c4ccc(F)cc4Cl)CCCCC3)CC2)c1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.44
ADRA1A P35348 1/20 0.44
MCHR1 Q99705 1/20 0.41

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
SCHEMBL4840449 0.99 DRD2 (0.45) DRD2ADRA1AMCHR1
SCHEMBL5512309 0.94 DRD2 (0.49) DRD2ADRA1A
SCHEMBL5515953 0.93 DRD2 (0.49) DRD2ADRA1A
SCHEMBL5519670 0.89 KCNH2 (0.48) DRD2ADRA1AMCHR1
SCHEMBL5517902 0.88 DRD2 (0.54) DRD2ADRA1AMCHR1
SCHEMBL5512917 0.88 DRD2 (0.47) DRD2ADRA1A
SCHEMBL5515533 0.88 KCNH2 (0.47) DRD2ADRA1AMCHR1
SCHEMBL5514892 0.88 DRD2 (0.54) DRD2ADRA1AMCHR1
SCHEMBL5508650 0.87 DRD2 (0.47) DRD2ADRA1A
SCHEMBL5517914 0.82 DRD2 (0.50) DRD2ADRA1AMCHR1

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
US-7199135-B2 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2007-04-03 US disclosed
US-7199135-B2 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2007-04-03 US disclosed
US-7105544-B2 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2006-09-12 US disclosed