SCHEMBL1749217

SCHEMBL1749217

Nc1ccc(N2CCC(CNC(=O)O)C2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
GFER P55789 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
RPS6KB1 P23443 7/20 0.44
NOTUM Q6P988 1/20 0.40
F10 P00742 1/20 0.39
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
GAA P10253 1/20 0.39
USP30 Q70CQ3 1/20 0.39
CHRM4 P08173 1/20 0.38
ACACB O00763 2/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL1749218 1.00 ALDH1A1 (0.44) ALDH1A1LMNAMAPTMAPK1GFER
SCHEMBL1749215 1.00 ALDH1A1 (0.44) ALDH1A1LMNAMAPTMAPK1GFER
SCHEMBL1749401 0.87 MAPT (0.46) ALDH1A1LMNAMAPTMAPK1GFER
SCHEMBL1749230 0.86 RPS6KB1 (0.39) ALDH1A1MAPTMAPK1GFERTDP1
SCHEMBL1749277 0.86 CHRM4 (0.40) ALDH1A1MAPTMAPK1GFERTDP1
SCHEMBL1750143 0.85 RBP4 (0.45) MAPTRPS6KB1NOTUMLPLLIPG
SCHEMBL1750584 0.85 CHRM4 (0.41) LMNAMAPTRPS6KB1GAAUSP30
SCHEMBL1750146 0.84 RPS6KB1 (0.40) ALDH1A1MAPTMAPK1TDP1RPS6KB1
SCHEMBL1750804 0.84 FFAR4 (0.41)
SCHEMBL4288054 0.84 ACACB (0.47) RPS6KB1F10ACACB

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-7968550-B2 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2011-06-28 US disclosed
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-09-06 US disclosed
US-7223788-B2 therapy for eating disorders, anorexigenic agents, antidiabetic agents, reducing weight in mammals, circadian rhythm disease, psychological disorders SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-29 US disclosed
US-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-11-04 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 (2 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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 ALDH1A1 286/4885LMNA 2677/4885MAPT 4824/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 ALDH1A1 374/4885LMNA 2573/4885MAPT 4800/4885

“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.