SCHEMBL8208766

SCHEMBL8208766

CCOC(=O)N1CCC(NC(=O)c2cccc(NC(=O)Cc3ccc4c(c3)OCO4)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
SIGMAR1 Q99720 2/20 0.49
KDM4E B2RXH2 3/20 0.48
HSD17B10 Q99714 2/20 0.48
MAPK1 P28482 2/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
APEX1 P27695 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MCHR1 Q99705 7/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
EPHX2 P34913 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL8206477 0.89 KMT2A (0.51) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL8213366 0.86 MAPK1 (0.58) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL12853603 0.82 MEN1 (0.55) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL17012010 0.81 KDM4E (0.58) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL8201487 0.81 MEN1 (0.53) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL8208762 0.80 KDM4E (0.57) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL8201484 0.80 KDM4E (0.57) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL8208996 0.77 LMNA (0.62) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL12853598 0.73 NOS2 (0.67) KMT2AMEN1KDM4EHSD17B10MAPK1
SCHEMBL8212461 0.73 KDM4E (0.60) KMT2AMEN1KDM4EHSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2132178-B1 JNK INHIBITORS MERCK SHARP & DOHME (US) 2015-08-19 EP disclosed
US-8278337-B2 Substituted pyridines that are JNK inhibitors MERCK SHARP & DOHME (US) 2012-10-02 US disclosed
US-8278337-B2 Substituted pyridines that are JNK inhibitors MERCK SHARP & DOHME (US) 2012-10-02 US disclosed
US-20100179141-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-07-15 US disclosed
US-20100179141-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-07-15 US disclosed
WO-2008082487-A2 NOVEL JNK INHIBITORS SCHERING CORPORATION (US) 2008-07-10 WO 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-20100179141-A1 NOVEL JNK INHIBITORS MAPK1, MAPKAPK5, MAPK15 KMT2A 4373/4885MEN1 3562/4885SIGMAR1 3054/4885

“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.