SCHEMBL13678564

SCHEMBL13678564

CC(C)(C)c1cc(N=C=O)n(-c2cccc(OCCOC3CCCCO3)c2)n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CHEK1 O14757 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK14 Q16539 11/20 0.32
MAPK9 P45984 2/20 0.32
CDK8 P49336 1/20 0.32
MAPK12 P53778 3/20 0.32
MAPK11 Q15759 3/20 0.32
MAPK13 O15264 2/20 0.32
GAA P10253 1/20 0.31
DHFR P00374 1/20 0.31

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
SCHEMBL4076105 0.84 KDM4C (0.41) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL4250862 0.81 MAPK14 (0.49) MAPK14MAPK9CDK8MAPK12MAPK11
SCHEMBL4139540 0.78 MEN1 (0.40) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL16398841 0.78 GAA (0.44) MAPK14MAPK9CDK8MAPK12MAPK11
SCHEMBL4505212 0.78 MAPK14 (0.48) MAPK14MAPK9CDK8MAPK12MAPK11
SCHEMBL16278814 0.77 KDM4C (0.39) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL4076188 0.76 KDM4C (0.42) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL15006786 0.76 GAA (0.42) MEN1KMT2AMAPK14MAPK9CDK8
SCHEMBL4078729 0.76 KDM4C (0.39) KDM4CMEN1KMT2ANPC1RAB9A
SCHEMBL16279038 0.75 ALDH1A1 (0.45) KDM4CMEN1KMT2ANPC1RAB9A

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-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 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-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PDXK, UMPS, CDK2 KDM4C 1262/4885MEN1 4558/4885KMT2A 2604/4885

“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.