SCHEMBL2409690

SCHEMBL2409690

CNC(=O)COC(=O)NCCCCN1C(=O)CCc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.49
DRD3 P35462 13/20 0.49
DRD4 P21917 12/20 0.49
CHRM1 P11229 5/20 0.47
CHRM2 P08172 4/20 0.47
CHRM3 P20309 4/20 0.47
CHRM4 P08173 3/20 0.47
CHRM5 P08912 3/20 0.47
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
ADRA1A P35348 2/20 0.45
CYP3A4 P08684 2/20 0.45
SLC6A2 P23975 2/20 0.45
SLC22A2 O15244 1/20 0.45
SLC22A1 O15245 1/20 0.45
SLC22A3 O75751 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45

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
SCHEMBL2413737 0.87 DRD2 (0.51) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL1310508 0.81 DRD2 (0.55) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL2838230 0.80 DRD2 (0.59) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL30987427 0.78 DRD2 (0.53) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL2409059 0.77 DRD2 (0.56) DRD2DRD3CYP1A2CYP2D6HTR2A
SCHEMBL26747676 0.74 MTNR1A (0.59) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL30987423 0.72 DRD2 (0.52) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL9690444 0.71 CHRM2 (0.65) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL3374155 0.71 DRD2 (0.77) DRD2DRD3DRD4CHRM1CHRM2
SCHEMBL5662612 0.71 CHRM2 (0.59) DRD2DRD3DRD4CHRM1CHRM2

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-20110237595-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2011-09-29 US disclosed
US-20100069405-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2010-03-18 US disclosed
US-7645757-B2 Derivatives of heteroaryl-alkylcarbamates, methods for their preparation and use thereof as fatty acid amido hydrolase enzyme inhibitors SANOFI-AVENTIS (FR) 2010-01-12 US disclosed
US-20070021426-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2007-01-25 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 (3 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-20110237595-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR1 DRD2 898/4885DRD3 727/4885DRD4 1065/4885
US-20100069405-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR1 DRD2 898/4885DRD3 727/4885DRD4 1065/4885
US-20070021426-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR2 DRD2 1932/4885DRD3 1067/4885DRD4 1940/4885

“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.