SCHEMBL5480904

SCHEMBL5480904

CN(C)c1ccc(CC(=O)NCCCN2CCCCC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.60
▸ GAA P10253 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ HDAC1 Q13547 1/20 0.55
▸ HRH3 Q9Y5N1 2/20 0.52
▸ CYP3A4 P08684 1/20 0.50
▸ ACHE P22303 1/20 0.48

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
SCHEMBL16511119 0.89 ALDH1A1 (0.73) ALDH1A1GAASMN1; SMN2CYP2D6HRH3
SCHEMBL16511225 0.88 ALDH1A1 (0.75) ALDH1A1GAASMN1; SMN2CYP2D6HRH3
SCHEMBL5476362 0.83 ALDH1A1 (0.64) ALDH1A1GAASMN1; SMN2CYP2D6HRH3
SCHEMBL14430765 0.83 KMT2A (0.64) ALDH1A1GAASMN1; SMN2CYP2D6HRH3
SCHEMBL5483450 0.82 DRD2 (0.60) ALDH1A1GAASMN1; SMN2CYP2D6HDAC1
SCHEMBL16511120 0.81 GAA (0.81) ALDH1A1GAASMN1; SMN2CYP2D6CYP3A4
SCHEMBL16511117 0.79 GAA (0.83) ALDH1A1GAASMN1; SMN2CYP2D6CYP3A4
SCHEMBL5474719 0.78 SMN1; SMN2 (0.60) ALDH1A1GAASMN1; SMN2CYP2D6HRH3
SCHEMBL31305357 0.77 ALDH1A1 (0.76) ALDH1A1GAASMN1; SMN2CYP2D6HRH3
SCHEMBL14430804 0.76 DRD2 (0.57) ALDH1A1GAASMN1; SMN2CYP2D6HDAC1

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-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 — — US disclosed
US-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 — — US disclosed
US-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 — — 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 (1 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-20070191358-A1 Novel piperidine derivative for the treatment of depression GRIN2C, TPH2, HTR5A ALDH1A1 172/4885GAA 4017/4885SMN1; SMN2 3605/4885

“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.

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