SCHEMBL13637765

SCHEMBL13637765

COc1cc(CN2C(=O)/C(=N\O)c3cc(C)cc(C)c32)cc(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.37
TP53 P04637 4/20 0.37
CHRM5 P08912 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PARK7 Q99497 1/20 0.35
CMA1 P23946 1/20 0.35
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
POLB P06746 2/20 0.33
GLA P06280 1/20 0.33
ELANE P08246 1/20 0.33
ALOX15 P16050 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL13627985 0.89 CHRM5 (0.48) MAPTTP53CHRM5SMN1; SMN2TDP1
SCHEMBL13627993 0.89 CMA1 (0.51) MAPTTP53CHRM5SMN1; SMN2CMA1
SCHEMBL13628001 0.88 CHRM5 (0.40) MAPTTP53CHRM5SMN1; SMN2TDP1
SCHEMBL13628091 0.82 APAF1 (0.42) MAPTCHRM5SMN1; SMN2CMA1ALDH1A1
SCHEMBL13627989 0.80 ALDH1A1 (0.40) MAPTTP53CHRM5SMN1; SMN2TDP1
SCHEMBL13627996 0.79 CHRM5 (0.50) MAPTTP53CHRM5SMN1; SMN2TDP1
SCHEMBL13628060 0.79 MAPT (0.45) MAPTTP53CHRM5CMA1ALDH1A1
SCHEMBL13627991 0.77 TP53 (0.46) MAPTTP53PARK7
SCHEMBL13628069 0.76 CHRM5 (0.47) MAPTCHRM5SMN1; SMN2PARK7CMA1
SCHEMBL13627958 0.76 ALDH1A1 (0.52) MAPTCHRM5SMN1; SMN2PARK7ALDH1A1

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-7612065-B2 Inhibitors of c-JUN N-terminal kinases (JNK) VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-11-03 US disclosed
EP-1175399-B1 INHIBITORS OF C-JUN N-TERMINAL KINASES (JNK) VERTEX PHARMA (US) 2009-03-11 EP disclosed
US-20080033022-A1 Inhibitors of c-Jun N-terminal kinases (JNK) SALITURO FRANCESCO G 2008-02-07 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 MAPT 1666/4885TP53 405/4885CHRM5 4815/4885

“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.