SCHEMBL1750596

SCHEMBL1750596

CN(C)C1CCN(c2ccc(NC(=O)c3ccc(OCc4ccccc4)cc3)cc2F)C1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 6/20 0.53
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NR1H4 Q96RI1 1/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CASP3 P42574 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
LMNA P02545 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
KIT P10721 1/20 0.48
DGAT1 O75907 1/20 0.48
MAPK14 Q16539 1/20 0.47

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
SCHEMBL1750594 1.00 MCHR1 (0.53) MCHR1KDM4EMAPTNPC1RAB9A
SCHEMBL1749849 0.87 NR1H4 (0.49) MCHR1NR1H4DGAT1
SCHEMBL1749850 0.87 NR1H4 (0.49) MCHR1NR1H4DGAT1
SCHEMBL12532130 0.87 MAPT (0.50) MCHR1KDM4EMAPTNPC1RAB9A
SCHEMBL12529203 0.86 MCHR1 (0.72) MCHR1KDM4EMAPTNPC1RAB9A
SCHEMBL12531042 0.85 KIT (0.42) MCHR1KDM4EMAPTKIT
SCHEMBL12528785 0.85 MCHR1 (0.47) MCHR1MAPTNR1H4KMT2AHSD17B10
SCHEMBL1750191 0.85 MCHR1 (0.55) MCHR1
SCHEMBL1750189 0.85 MCHR1 (0.55) MCHR1
SCHEMBL1748855 0.83 MCHR1 (0.49) MCHR1

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 MCHR1 1838/4885KDM4E 2966/4885MAPT 4824/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 MCHR1 2068/4885KDM4E 2896/4885MAPT 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.