SCHEMBL15944875

SCHEMBL15944875

CC(C)C/C(Cl)=N/Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.47
GRIN2B Q13224 12/20 0.43
GRIN1 Q05586 8/20 0.43
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
SIGMAR1 Q99720 2/20 0.40
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
TRPA1 O75762 1/20 0.36
ANPEP P15144 1/20 0.36
RNPEP Q9H4A4 1/20 0.36
DNPEP Q9ULA0 1/20 0.36

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
SCHEMBL14093510 0.72 NOS2 (0.53) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL14117381 0.71 NOS2 (0.57) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL15944878 0.69 NOS2 (0.50) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL4740345 0.69 NOS2 (0.60) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL22068857 0.69 NOS2 (0.65) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL22068858 0.69 NOS2 (0.65) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL104888 0.69 NOS2 (0.65) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL7466196 0.68 GRIN2B (0.59) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL7830039 0.68 GRIN2B (0.59) NOS2GRIN2BGRIN1GRIN2DGRIN3B
SCHEMBL2298200 0.68 GRIN2B (0.54) NOS2GRIN2BGRIN1GRIN2DGRIN3B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES Brock Unviersity (CA) 2014-08-14 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-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES CA6, RUVBL2, HACL2 NOS2 1337/4885GRIN2B 1330/4885GRIN1 1346/4885

“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.