SCHEMBL3262478

SCHEMBL3262478

C=CCN1CCCCC1C(NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 2/20 0.42
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.41
OPRK1 P41145 1/20 0.41
OPRD1 P41143 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
SCHEMBL1799303 0.84 SLC6A9 (0.55) SLC6A9
SCHEMBL1799304 0.84 SLC6A9 (0.55) SLC6A9
SCHEMBL4588331 0.80 SLC6A9 (0.73) SLC6A9
SCHEMBL6818965 0.80 SLC6A9 (0.62) SLC6A9ALDH1A1MEN1MAPK1KMT2A
SCHEMBL1795969 0.77 LMNA (0.43) LMNAOPRD1
SCHEMBL1795967 0.77 LMNA (0.43) LMNAOPRD1
SCHEMBL3536545 0.77 SLC6A9 (0.69) SLC6A9
SCHEMBL1797557 0.74 OPRD1 (0.45) OPRK1OPRD1
SCHEMBL1797560 0.74 OPRD1 (0.45) OPRK1OPRD1
SCHEMBL3515953 0.74 OPRD1 (0.45) OPRK1OPRD1

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-7790753-B2 Derivatives of N-[phenyl(alkylpiperidine-2-yl)methyl]benzamide, preparation method thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2010-09-07 US disclosed
US-20060223861-A1 Derivatives of N-[phenyl(alkylpiperidine-2-yl)methyl]benzamide, preparation method thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2006-10-05 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-20060223861-A1 Derivatives of N-[phenyl(alkylpiperidine-2-yl)methyl]benzamide, preparation method thereof and application of same in therapeutics SNCA, CHRNA5, GABRE SLC6A9 3560/4885ALDH1A1 766/4885MEN1 743/4885

“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.