SCHEMBL493624

SCHEMBL493624

CN(C)c1ccccc1CC1CCC(CNC(=O)COC(C2CCCN2)S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)CC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 1/20 0.35
KMT2A Q03164 1/20 0.33
GHSR Q92847 2/20 0.32
GRM5 P41594 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
AHCY P23526 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL494051 0.91 HPGD (0.34) KMT2AGHSRL3MBTL1NPSR1LMNA
SCHEMBL3771275 0.77 LSS (0.38) KMT2AGHSRL3MBTL1LMNAMAPT
SCHEMBL493518 0.76 PTGIR (0.36) FDFT1KMT2AGRM5
SCHEMBL3763394 0.75 LSS (0.38) ALDH1A1
SCHEMBL493466 0.74 LMNA (0.39) LMNAMAPT
SCHEMBL5093762 0.74 SLC6A3 (0.35) CYP1A2CYP2D6NPSR1
SCHEMBL493161 0.73 FDFT1 (0.36) FDFT1KMT2AGRM5
SCHEMBL3764001 0.72 ACHE (0.40) KMT2AALDH1A1
SCHEMBL3775189 0.71 KMT2A (0.38) KMT2AMAPTALDH1A1
SCHEMBL3774715 0.71 GAA (0.39) KMT2AL3MBTL1NPSR1MAPTALDH1A1

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-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US claimed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US claimed
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD FDFT1 1192/4885KMT2A 1749/4885GHSR 3085/4885

“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.