Sugi Predict

Sugi Predict / Compounds / SCHEMBL5508604

SCHEMBL5508604

SCHEMBL5508604

CC(C)(C)CC(=O)Nc1cccc(C2CCN(CCCNC(=O)C(c3ccccc3)c3ccccc3)CC2)c1

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 1/20 0.62
▸ ADRA1A P35348 1/20 0.62
▸ ADRA1B P35368 1/20 0.62
▸ SLC6A2 P23975 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54

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
SCHEMBL5521958 0.90 ADRA1D (0.65) ADRA1DADRA1AADRA1BSLC6A2SLC6A3
SCHEMBL5923752 0.89 ADRA1D (0.64) ADRA1DADRA1AADRA1BSLC6A2SLC6A3
SCHEMBL5515343 0.89 ADRA1D (0.64) ADRA1DADRA1AADRA1BSLC6A2SLC6A3
SCHEMBL5511305 0.88 ADRA1D (0.68) ADRA1DADRA1AADRA1BSLC6A2SLC6A3
SCHEMBL6714204 0.88 ADRA1D (0.67) ADRA1DADRA1AADRA1B
SCHEMBL5888068 0.86 ADRA1D (0.64) ADRA1DADRA1AADRA1BSLC6A2SLC6A3
SCHEMBL14619777 0.85 ADRA1D (0.63) ADRA1DADRA1AADRA1B
SCHEMBL4794082 0.84 ADRA1D (0.62) ADRA1DADRA1AADRA1BSLC6A2SLC6A3
SCHEMBL14619779 0.84 ADRA1D (0.62) ADRA1DADRA1AADRA1B
SCHEMBL5512821 0.83 ADRA1D (0.60) ADRA1DADRA1AADRA1BSLC6A2SLC6A3

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 9 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-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 ADRA1D 45/4885ADRA1A 54/4885ADRA1B 61/4885
US-20060084649-A9 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R ADRA1D 45/4885ADRA1A 54/4885ADRA1B 61/4885
US-20060041139-A9 SUBSTITUTED ALKYL AMIDO PIPERIDINES MCHR1, MCHR2, MC1R ADRA1D 45/4885ADRA1A 54/4885ADRA1B 61/4885
US-20060217418-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R ADRA1D 45/4885ADRA1A 54/4885ADRA1B 61/4885
US-20040186103-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R ADRA1D 45/4885ADRA1A 54/4885ADRA1B 61/4885

“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.