SCHEMBL6327436

SCHEMBL6327436

CC(CC(N)=O)Cc1ccc2[nH]nc(-c3cc4ccccc4o3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
SYK P43405 1/20 0.40
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
PLAU P00749 1/20 0.37
KCNH2 Q12809 1/20 0.37
SCN5A Q14524 1/20 0.37
MMP12 P39900 1/20 0.37
MMP13 P45452 1/20 0.37
JAK2 O60674 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
SCHEMBL5381355 0.85 ITK (0.47) KDRSIRT2SIRT1MAPTTP53
SCHEMBL5384828 0.84 SIRT2 (0.45) KDRSIRT2SIRT1MAPTTP53
SCHEMBL5379514 0.80 SIRT2 (0.41) KDRSIRT2SIRT1MAPTTP53
SCHEMBL5381421 0.80 KDR (0.41) KDRSIRT2SIRT1MAPTTP53
SCHEMBL5373372 0.77 SIRT2 (0.48) KDRSIRT2SIRT1MAPTTP53
SCHEMBL5382584 0.75 SIRT2 (0.40) KDRSIRT2SIRT1MAPTTP53
SCHEMBL5386544 0.74 SIRT2 (0.39) KDRSIRT2SIRT1MAPTTP53
SCHEMBL8258574 0.74 MAPK1 (0.49) KDR
SCHEMBL8257912 0.74 MAPK1 (0.49) KMT2AHSD17B10
SCHEMBL2872714 0.74 ITK (0.48) KDRSIRT2SIRT1MAPTTP53

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-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SINGNAL PHARMACEUTICALS, INC. 2005-05-19 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-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 KDR 2449/4885SIRT2 2000/4885SIRT1 1269/4885

“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.