SCHEMBL1748996

SCHEMBL1748996

CN1CC(C(=O)N(C)C2CCN(c3ccc(NC(=O)Nc4ccc(OC5CCCC5)cc4)cc3)C2)CC1=O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.45
ACACB O00763 5/20 0.40
HRH3 Q9Y5N1 3/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL1748923 0.89 TP53 (0.47) MCHR1ALDH1A1MAPT
SCHEMBL1749888 0.89 MCHR1 (0.47) MCHR1HRH3ALDH1A1MAPT
SCHEMBL1750271 0.86 MCHR1 (0.44) MCHR1ACACBHRH3ALDH1A1MAPT
SCHEMBL1749298 0.86 KMT2A (0.47) MCHR1ALDH1A1MAPT
SCHEMBL1749256 0.85 MCHR1 (0.56) MCHR1ACACBHRH3ALDH1A1MAPT
SCHEMBL1750690 0.85 MCHR1 (0.56) MCHR1ACACBHRH3ALDH1A1MAPT
SCHEMBL2636754 0.85 MCHR1 (0.56) MCHR1ACACBHRH3ALDH1A1MAPT
SCHEMBL1750689 0.85 MCHR1 (0.51) MCHR1ACACBHRH3ALDH1A1MAPT
SCHEMBL12528964 0.83 MCHR1 (0.46) MCHR1ACACBHRH3ALDH1A1MAPT
SCHEMBL1748755 0.83 HRH3 (0.45) MCHR1ACACBHRH3

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 6 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-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-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-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

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-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 MCHR1 2068/4885ACACB 3866/4885HRH3 748/4885

“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.