SCHEMBL2412802

SCHEMBL2412802

O=C(NCCc1ccc(-c2ccccc2)nc1)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
MAPT P10636 1/20 0.50
KEAP1 Q14145 2/20 0.48
NFE2L2 Q16236 2/20 0.48
HPGDS O60760 1/20 0.48
TGM2 P21980 1/20 0.46
PLAU P00749 1/20 0.45
IDO1 P14902 1/20 0.45
KCNK3 O14649 1/20 0.44
KCNA3 P22001 1/20 0.44
KCNA5 P22460 1/20 0.44
PDE1B Q01064 1/20 0.44
HIF1A Q16665 1/20 0.44

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
SCHEMBL2840773 0.88 HPGDS (0.45) SMN1; SMN2MAPTHPGDSHIF1A
SCHEMBL2412426 0.83 RECQL (0.46) SMN1; SMN2MAPTHPGDS
SCHEMBL2846480 0.83 HPGDS (0.52) SMN1; SMN2MAPTHPGDSHIF1A
SCHEMBL6027765 0.81 HPGDS (0.44) SMN1; SMN2HPGDSHIF1A
SCHEMBL17273999 0.81 CKS1B (0.50) SMN1; SMN2HPGDSIDO1
Benzyl Phenethylcarbamate SCHEMBL4287199 0.81 LMNA (0.73) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL6027764 0.81 HPGDS (0.43) SMN1; SMN2HPGDSHIF1A
SCHEMBL2414440 0.79 RAB9A (0.44) LMNASMN1; SMN2L3MBTL1MAPTHPGDS
SCHEMBL6554125 0.78 LMNA (0.65) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL27789206 0.78 ROCK2 (0.62) SMN1; SMN2MAPT

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 LMNA 2092/4885SMN1; SMN2 2750/4885HTT 2080/4885
US-20100069405-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR1 LMNA 2092/4885SMN1; SMN2 2750/4885HTT 2080/4885
US-20070021426-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, METHODS FOR THEIR PREPARATION AND USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR2 LMNA 1471/4885SMN1; SMN2 3539/4885HTT 2616/4885

“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.