SCHEMBL10208482

SCHEMBL10208482

CC(=O)c1cn(C[C@@H]2CCCN2C(=O)OC(C)(C)C)cc(OCc2ccccc2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.48
PRMT5 O14744 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PARP1 P09874 1/20 0.41
IL1B P01584 2/20 0.40
P2RX7 Q99572 1/20 0.40
HRH3 Q9Y5N1 2/20 0.39
OPRD1 P41143 1/20 0.39
NPC1 O15118 1/20 0.39
MET P08581 1/20 0.39
GHSR Q92847 1/20 0.38
KDM1A O60341 1/20 0.38
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
YAP1 P46937 1/20 0.37
FKBP1A P62942 1/20 0.37
SPHK2 Q9NRA0 1/20 0.37

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
SCHEMBL19220604 0.78 PRMT5 (0.44) KLK7PRMT5MEN1KMT2APARP1
SCHEMBL4314700 0.74 PRMT5 (0.56) KLK7PRMT5GHSRYAP1SPHK2
SCHEMBL2895175 0.74 PRMT5 (0.56) KLK7PRMT5GHSRYAP1SPHK2
SCHEMBL4314170 0.74 PRMT5 (0.56) KLK7PRMT5GHSRYAP1SPHK2
SCHEMBL19157589 0.74 PRMT5 (0.44) KLK7PRMT5MEN1KMT2APARP1
SCHEMBL7908488 0.74 KLK7 (0.52) KLK7PRMT5MEN1KMT2APARP1
SCHEMBL7908485 0.74 KLK7 (0.52) KLK7PRMT5MEN1KMT2APARP1
SCHEMBL4664791 0.74 KLK7 (0.52) KLK7PRMT5MEN1KMT2APARP1
SCHEMBL845991 0.73 KLK7 (0.47) KLK7PRMT5MEN1KMT2APARP1
SCHEMBL698218 0.73 NR1H2 (0.54) KLK7MEN1KMT2AOPRD1KDM1A

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-8835461-B2 Substituted 3-hydroxy-4-pyridone derivative SHIONOGI & CO., LTD. (JP) 2014-09-16 US disclosed
US-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2012-01-26 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-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE ENDOD1, CNBP, DPP4 KLK7 1425/4885PRMT5 2435/4885MEN1 4625/4885

“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.