SCHEMBL5484126

SCHEMBL5484126

O=C(NCCCN1CCCCC1)c1ccc(Oc2cc(Cl)cc(Cl)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
POLB P06746 1/20 0.54
MAPT P10636 2/20 0.54
RECQL P46063 1/20 0.54
CACNA1G O43497 2/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A4 P31645 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
LMNA P02545 1/20 0.52
GLA P06280 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CCR2 P41597 1/20 0.51
KMT2A Q03164 2/20 0.50
CHRM4 P08173 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
SCN9A Q15858 1/20 0.50
L3MBTL3 Q96JM7 1/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL5485422 0.88 DRD4 (0.59) MAPTSLC6A2SLC6A4L3MBTL1LMNA
SCHEMBL5484460 0.87 ALDH1A1 (0.53) ALDH1A1POLBMAPTRECQLCACNA1G
SCHEMBL14430677 0.86 CHRM4 (0.62) ALDH1A1POLBMAPTRECQLL3MBTL1
SCHEMBL5477276 0.85 MCHR1 (0.54) ALDH1A1POLBMAPTRECQLL3MBTL1
SCHEMBL5481939 0.85 TSHR (0.66) ALDH1A1POLBMAPTRECQLL3MBTL1
SCHEMBL5474324 0.85 POLB (0.75) ALDH1A1POLBMAPTRECQLCACNA1G
SCHEMBL5483156 0.85 SCN9A (0.59) ALDH1A1POLBMAPTRECQLL3MBTL1
SCHEMBL18502089 0.84 L3MBTL3 (0.64) ALDH1A1CACNA1GSLC6A4L3MBTL1CHRM4
SCHEMBL14430792 0.84 POLB (0.56) ALDH1A1POLBMAPTRECQLCACNA1G
SCHEMBL14430801 0.83 EPHX2 (0.61) ALDH1A1POLBMAPTRECQLL3MBTL1

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 2 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

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 172/4885POLB 1519/4885MAPT 983/4885

“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.