SCHEMBL1748768

SCHEMBL1748768

CN(C)C1CCN(c2ccc(NC(=O)c3ccc(-c4ccc(F)cc4F)s3)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 16/20 0.51
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
ESRRG P62508 1/20 0.43
WDR5 P61964 1/20 0.42
NSD2 O96028 1/20 0.41
SETD2 Q9BYW2 1/20 0.41

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
SCHEMBL12529229 0.87 MCHR1 (0.61) MCHR1NPC1MAPTRAB9AESRRG
SCHEMBL1749569 0.83 MCHR1 (0.69) MCHR1NPC1MAPTRAB9AWDR5
SCHEMBL1749061 0.82 NPC1 (0.59) MCHR1NPC1MAPTRAB9AWDR5
SCHEMBL1749549 0.82 MCHR1 (0.60) MCHR1NPC1MAPTRAB9AESRRG
SCHEMBL12531288 0.81 MCHR1 (0.62) MCHR1ESRRG
SCHEMBL14532658 0.80 NPC1 (0.54) MCHR1NPC1MAPTRAB9AWDR5
SCHEMBL1750685 0.79 MCHR1 (0.69) MCHR1NPC1MAPTRAB9AWDR5
SCHEMBL14502070 0.79 MCHR1 (0.66) MCHR1NPC1MAPTRAB9AWDR5
SCHEMBL12530805 0.79 MCHR1 (0.66) MCHR1NPC1MAPTRAB9A
SCHEMBL12529716 0.78 MCHR1 (0.58) MCHR1NPC1MAPTRAB9A

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 2068/4885NPC1 1718/4885MAPT 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.