SCHEMBL12529050

SCHEMBL12529050

CN(C)C1CCN(c2ccc(NC(=O)N3CCN(Cc4ccc(Cl)cc4)CC3)cc2)C1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 7/20 0.59
▸ FAAH O00519 7/20 0.58
▸ CA12 O43570 2/20 0.55
▸ CA2 P00918 2/20 0.55
▸ CA9 Q16790 2/20 0.55
▸ CA1 P00915 1/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ NLRP3 Q96P20 1/20 0.53
▸ MAPK1 P28482 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPT P10636 1/20 0.50

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
SCHEMBL12528761 0.91 MCHR1 (0.61) MCHR1FAAHCA12CA2CA9
SCHEMBL12529024 0.91 MCHR1 (0.61) MCHR1FAAHCA12CA2CA9
SCHEMBL12529014 0.90 MCHR1 (0.65) MCHR1CA12CA2CA9CA1
SCHEMBL12529086 0.89 MCHR1 (0.52) MCHR1FAAHCA12CA2CA9
SCHEMBL12528767 0.86 MCHR1 (0.64) MCHR1CA12CA2CA9SMN1; SMN2
SCHEMBL12528881 0.84 MCHR1 (0.75) MCHR1CA12CA2CA9SMN1; SMN2
SCHEMBL12529071 0.84 MCHR1 (0.57) MCHR1CA12CA2CA9SMN1; SMN2
SCHEMBL14415286 0.82 MCHR1 (0.56) MCHR1CA12CA2CA9SMN1; SMN2
SCHEMBL12528869 0.82 MCHR1 (0.58) MCHR1CA12CA2CA9SMN1; SMN2
SCHEMBL12528771 0.81 CCR2 (0.52) MCHR1MAPT

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 2068/4885FAAH 839/4885CA12 2612/4885

“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.

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