SCHEMBL1749208

SCHEMBL1749208

CC(=O)CNC1CCN(c2ccc(NC(=O)CCl)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 1/20 0.54
GAA P10253 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NAMPT P43490 2/20 0.45
MCHR1 Q99705 4/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MCL1 Q07820 1/20 0.44
HRH3 Q9Y5N1 5/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HTT P42858 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL6207691 0.92 MCHR1 (0.55) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL2636503 0.84 MCHR1 (0.46) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL1751085 0.84 NPC1 (0.53) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL2636329 0.81 GFER (0.47) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL1750755 0.81 MCHR1 (0.68) ALDH1A1SMN1; SMN2MAPTKDM4EMCHR1
SCHEMBL1749074 0.81 NPC1 (0.50) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL1749800 0.80 MCHR1 (0.56) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL1748296 0.80 KMT2A (0.60) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL1749502 0.79 NPC1 (0.55) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL1749172 0.79 GAA (0.54) ALDH1A1LMNASMN1; SMN2MAPTGAA

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 2677/4885SMN1; SMN2 1857/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 ALDH1A1 374/4885LMNA 2573/4885SMN1; SMN2 1946/4885

“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.