SCHEMBL1749512

SCHEMBL1749512

CNc1ccc(N2CCC(CNC(=O)O)C2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
NPY2R P49146 5/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
MCL1 Q07820 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RPS6KB1 P23443 5/20 0.41
MTTP P55157 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL1749509 1.00 MAPT (0.42) MAPTALDH1A1ALOX15MAPK1NPY2R
SCHEMBL1750085 0.88 NPY2R (0.42) MAPTALDH1A1ALOX15MAPK1NPY2R
SCHEMBL1750087 0.88 NPY2R (0.42) MAPTALDH1A1ALOX15MAPK1NPY2R
SCHEMBL1749747 0.86 PTGS1 (0.42) MAPTMEN1KMT2ARPS6KB1
SCHEMBL1749750 0.86 PTGS1 (0.42) MAPTMEN1KMT2ARPS6KB1
SCHEMBL1749218 0.84 ALDH1A1 (0.44) MAPTALDH1A1MAPK1TDP1RPS6KB1
SCHEMBL1749215 0.84 ALDH1A1 (0.44) MAPTALDH1A1MAPK1TDP1RPS6KB1
SCHEMBL1749217 0.84 ALDH1A1 (0.44) MAPTALDH1A1MAPK1TDP1RPS6KB1
SCHEMBL1750146 0.78 RPS6KB1 (0.40) MAPTALDH1A1ALOX15MAPK1KDM4E
SCHEMBL1749511 0.76 FPR1 (0.44) MAPTNPY2RMEN1KMT2AKDM4E

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 MAPT 4824/4885ALDH1A1 286/4885ALOX15 474/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 MAPT 4800/4885ALDH1A1 374/4885ALOX15 424/4885

“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.