SCHEMBL1749465

SCHEMBL1749465

CC(=O)CNC1CCN(c2ccc(NC(=O)Cc3ccc(OCc4ccccc4)cc3)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.55
NPC1 O15118 4/20 0.55
MCL1 Q07820 1/20 0.55
MCHR1 Q99705 2/20 0.52
MAPT P10636 5/20 0.52
ALDH1A1 P00352 4/20 0.52
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.52
KDM4E B2RXH2 2/20 0.50
NR4A1 P22736 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
ACACB O00763 1/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
HPGD P15428 1/20 0.47
ME3 Q16798 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
SCHEMBL1749502 0.90 NPC1 (0.55) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1749126 0.89 MAPT (0.65) RAB9ANPC1MCHR1MAPTALDH1A1
SCHEMBL1749023 0.88 MAPT (0.49) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1749177 0.88 MAPT (0.49) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1750755 0.87 MCHR1 (0.68) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1748790 0.87 MAPT (0.53) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1749574 0.87 MCHR1 (0.47) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1751085 0.86 NPC1 (0.53) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1749466 0.83 MCHR1 (0.65) RAB9ANPC1MCL1MCHR1MAPT
SCHEMBL1748296 0.82 KMT2A (0.60) RAB9ANPC1MCL1MAPTALDH1A1

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 3 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

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 RAB9A 4386/4885NPC1 1718/4885MCL1 2216/4885

“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.