SCHEMBL1750696

SCHEMBL1750696

CN(C(=O)O)C1CCN(c2ccc(N)c(F)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 7/20 0.44
NPY5R Q15761 2/20 0.43
MCHR1 Q99705 4/20 0.42
FPR1 P21462 2/20 0.41
FPR2 P25090 2/20 0.41
SETD2 Q9BYW2 2/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
NSD2 O96028 1/20 0.38
CHRM4 P08173 1/20 0.38
MAP4K4 O95819 1/20 0.38

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
SCHEMBL1749372 1.00 NOTUM (0.44) NOTUMNPY5RMCHR1FPR1FPR2
SCHEMBL4291539 0.90 MCHR1 (0.49) NOTUMNPY5RMCHR1FPR1FPR2
SCHEMBL1749968 0.86 GAA (0.43) NOTUMMCHR1SETD2NSD2CHRM4
SCHEMBL1749590 0.86 NOTUM (0.51) NOTUMMCHR1CHRM4
SCHEMBL1749532 0.85 MCHR1 (0.42) NOTUMNPY5RMCHR1CHRM4MAP4K4
SCHEMBL31084534 0.84 FPR1 (0.44) NOTUMNPY5RMCHR1FPR1FPR2
SCHEMBL4263614 0.84 FPR1 (0.44) NOTUMNPY5RMCHR1FPR1FPR2
SCHEMBL4259168 0.84 FPR1 (0.44) NOTUMNPY5RMCHR1FPR1FPR2
SCHEMBL4259518 0.84 PDE10A (0.43) NOTUMNPY5RMCHR1FPR1FPR2
SCHEMBL27760852 0.84 PDE10A (0.43) NOTUMNPY5RMCHR1FPR1FPR2

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 NOTUM 2483/4885NPY5R 2277/4885MCHR1 1838/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 NOTUM 2170/4885NPY5R 1978/4885MCHR1 2068/4885

“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.