SCHEMBL13627993

SCHEMBL13627993

COc1cccc(CN2C(=O)/C(=N\O)c3cc(C)cc(C)c32)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.51
CHRM5 P08912 3/20 0.48
MAPT P10636 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
IDH1 O75874 2/20 0.43
TP53 P04637 3/20 0.43
GAA P10253 1/20 0.42
MIF P14174 2/20 0.41
CD74 P04233 1/20 0.41
LMNA P02545 1/20 0.40
ALDH3A1 P30838 1/20 0.40

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
SCHEMBL13627989 0.89 ALDH1A1 (0.40) CMA1CHRM5MAPTKMT2AMEN1
SCHEMBL13637765 0.89 MAPT (0.37) CMA1CHRM5MAPTKMT2AMEN1
SCHEMBL13627985 0.88 CHRM5 (0.48) CMA1CHRM5MAPTKMT2AMEN1
SCHEMBL13627984 0.83 ALDH1A1 (0.48) MAPTKMT2AMEN1ALDH1A1POLB
SCHEMBL13627999 0.79 CHRM5 (0.43) CHRM5MAPTKMT2AMEN1ALDH1A1
SCHEMBL13628001 0.78 CHRM5 (0.40) CHRM5MAPTKMT2AMEN1ALDH1A1
SCHEMBL13627996 0.78 CHRM5 (0.50) CMA1CHRM5MAPTKDM4ESMN1; SMN2
SCHEMBL13627991 0.76 TP53 (0.46) MAPTTP53
SCHEMBL13627990 0.74 MAPT (0.44) MAPTKMT2AALDH1A1HPGDMAPK1
SCHEMBL13628009 0.73 KMT2A (0.48) MAPTKMT2AMEN1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612065-B2 Inhibitors of c-JUN N-terminal kinases (JNK) VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-11-03 US disclosed
US-20080033022-A1 Inhibitors of c-Jun N-terminal kinases (JNK) SALITURO FRANCESCO G 2008-02-07 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-20080033022-A1 Inhibitors of c-Jun N-terminal kinases (JNK) MAP3K1, JUN, MAP3K7 CMA1 1855/4885CHRM5 4815/4885MAPT 1666/4885

“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.