SCHEMBL8484165

SCHEMBL8484165

CCOC(=O)/C=C/C1(c2ccccc2)CCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
OPRM1 P35372 5/20 0.46
MAPT P10636 5/20 0.45
OPRD1 P41143 3/20 0.45
OPRK1 P41145 3/20 0.45
SLC22A1 O15245 1/20 0.45
SLC6A4 P31645 1/20 0.45
ADRA1A P35348 1/20 0.45
KCNH2 Q12809 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 3/20 0.43
MDM2 Q00987 2/20 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
SCHEMBL8484168 1.00 L3MBTL1 (0.50) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL8486337 0.99 L3MBTL1 (0.49) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL8486339 0.99 L3MBTL1 (0.49) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL8486160 0.94 L3MBTL1 (0.52) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL8486156 0.94 L3MBTL1 (0.52) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL11704583 0.87 L3MBTL1 (0.47) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL12000497 0.85 OPRM1 (0.45) L3MBTL1OPRM1MAPTSLC6A4MEN1
SCHEMBL28249200 0.84 KDM4E (0.47) L3MBTL1OPRM1MAPTOPRD1OPRK1
SCHEMBL31650308 0.82 LMNA (0.45) L3MBTL1MAPTSMN1; SMN2MEN1CYP1A2
SCHEMBL6203975 0.81 RAB9A (0.39) L3MBTL1MAPTSMN1; SMN2MEN1KMT2A

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 5 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-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
US-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2012-01-26 US disclosed
WO-1999015524-A1 THIAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 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-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE ENDOD1, CNBP, DPP4 L3MBTL1 1761/4885OPRM1 4291/4885MAPT 4155/4885

“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.