SCHEMBL5511368

SCHEMBL5511368

COc1ccc(NC(=O)C(C)C)cc1C1CCN(C(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ACHE P22303 1/20 0.44
BACE1 P56817 1/20 0.44
DRD2 P14416 4/20 0.44
ADRA1A P35348 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.42
DRD4 P21917 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
SCHEMBL5522042 0.85 DRD2 (0.55) KMT2ADRD2ADRA1ANPC1TP53
SCHEMBL5512313 0.82 HTR2C (0.48) KMT2ANPC1TP53RAB9ASMN1; SMN2
SCHEMBL4775506 0.81 DRD2 (0.48) DRD2ADRA1ASMN1; SMN2
SCHEMBL4771915 0.77 MEN1 (0.52) MEN1KMT2AL3MBTL1MAPTLMNA
SCHEMBL5888274 0.77 ADRA1D (0.54) ADRA1A
SCHEMBL4765169 0.76 DRD2 (0.62) DRD2ADRA1A
SCHEMBL5888272 0.75 DRD2 (0.44) DRD2
SCHEMBL1094926 0.74 PTGDR2 (0.55) MEN1KMT2A
SCHEMBL2637185 0.73 MEN1 (0.77) MEN1KMT2ADRD2MAPTDRD4
SCHEMBL4765012 0.73 DRD2 (0.53) MEN1KMT2ADRD2ADRA1AL3MBTL1

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 4 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-20060084649-A9 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2006-04-20 US disclosed
US-20040186103-A1 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION 2004-09-23 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 (3 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-20060084649-A9 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R MEN1 293/4885KMT2A 1399/4885ACHE 3171/4885
US-20060217418-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R MEN1 293/4885KMT2A 1399/4885ACHE 3171/4885
US-20040186103-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R MEN1 293/4885KMT2A 1399/4885ACHE 3171/4885

“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.