SCHEMBL427884

SCHEMBL427884

CCOC(=O)c1c[nH]c(C)c(OCc2ccccc2)c1=O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.54
GABRB2 P47870 3/20 0.54
GABRB1 P18505 2/20 0.54
GABRA3 P34903 2/20 0.54
POLB P06746 1/20 0.51
CLEC4M Q9H2X3 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
HSP90AA1 P07900 1/20 0.48
JAK2 O60674 2/20 0.48
JAK3 P52333 2/20 0.48
MAOB P27338 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL18803837 0.89 GABRA1 (0.53) GABRA1GABRB2GABRB1GABRA3POLB
SCHEMBL6692156 0.78 CLEC4M (0.67) GABRA1GABRB2GABRB1GABRA3POLB
SCHEMBL4906659 0.77 GABRA1 (0.71) GABRA1GABRB2GABRB1GABRA3POLB
SCHEMBL4176704 0.77 MDH2 (0.76) GABRA1GABRB2GABRB1GABRA3SMN1; SMN2
SCHEMBL10493397 0.77 CLEC4M (0.56) GABRA1GABRB2GABRB1GABRA3CLEC4M
SCHEMBL20751064 0.77 POLB (0.51) GABRA1GABRB2GABRB1GABRA3POLB
SCHEMBL19853588 0.77 ALDH1A1 (0.49) GABRA1GABRB2GABRB1GABRA3POLB
SCHEMBL15934472 0.77 MAOB (0.53) KMT2AMEN1HSP90AA1MAOBNPC1
SCHEMBL7434700 0.76 CLEC4M (0.54) GABRA1GABRB2GABRB1GABRA3CLEC4M
SCHEMBL5161582 0.76 GABRA1 (0.64) GABRA1GABRB2GABRB1GABRA3POLB

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 3 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
EP-2412708-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE Shionogi&Co., Ltd. (JP) 2012-02-01 EP 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 GABRA1 4366/4885GABRB2 4405/4885GABRB1 4295/4885

“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.