SCHEMBL5508600

SCHEMBL5508600

CC(C)(C)CC(=O)Nc1cccc(C2CCN(CCCN(C(=O)Cc3ccccc3)C(=O)Cc3ccccc3)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.56
MCHR1 Q99705 6/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
ACKR3 P25106 2/20 0.47

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
SCHEMBL5521956 0.90 DRD2 (0.53) DRD2MCHR1
SCHEMBL5923750 0.88 DRD2 (0.56) DRD2MCHR1DRD4DRD3
SCHEMBL5888239 0.84 DRD2 (0.51) DRD2MCHR1
SCHEMBL4772009 0.83 DRD2 (0.53) DRD2MCHR1
SCHEMBL4772209 0.83 EPHX2 (0.52) DRD2MCHR1DRD4DRD3ACKR3
SCHEMBL6714203 0.80 DRD2 (0.44) DRD2MCHR1
SCHEMBL5508604 0.78 ADRA1D (0.62)
SCHEMBL4791777 0.77 OPRM1 (0.47) DRD2
SCHEMBL4768518 0.76 DRD2 (0.47) DRD2
SCHEMBL5662528 0.75 DRD2 (0.88) DRD2MCHR1DRD4DRD3ACKR3

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 7 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-20060217418-A1 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2006-09-28 US disclosed
US-7105544-B2 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2006-09-12 US disclosed
US-20060084649-A9 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2006-04-20 US disclosed
US-20060041139-A9 SUBSTITUTED ALKYL AMIDO PIPERIDINES H. LUNDBECK A/S (DK) 2006-02-23 US disclosed
US-20040186103-A1 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION 2004-09-23 US disclosed
US-20040073036-A1 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION 2004-04-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040073036-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R DRD2 74/4885MCHR1 1/4885DRD4 80/4885
US-20060084649-A9 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R DRD2 74/4885MCHR1 1/4885DRD4 80/4885
US-20060041139-A9 SUBSTITUTED ALKYL AMIDO PIPERIDINES MCHR1, MCHR2, MC1R DRD2 74/4885MCHR1 1/4885DRD4 80/4885
US-20060217418-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R DRD2 74/4885MCHR1 1/4885DRD4 80/4885
US-20040186103-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R DRD2 74/4885MCHR1 1/4885DRD4 80/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.