SCHEMBL4882317

SCHEMBL4882317

O=C(Nc1cccc(OCc2ccccc2)c1)C(=O)C1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 7/20 0.57
NR1H4 Q96RI1 1/20 0.52
PDK1 Q15118 1/20 0.52
PDK2 Q15119 1/20 0.52
PDK3 Q15120 1/20 0.52
PDK4 Q16654 1/20 0.52
CTSV O60911 1/20 0.50
CTSL P07711 1/20 0.50
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SPHK2 Q9NRA0 1/20 0.49
SPHK1 Q9NYA1 1/20 0.49
SIRT2 Q8IXJ6 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
SIRT3 Q9NTG7 1/20 0.49

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
SCHEMBL8409075 0.87 F10 (0.72) F10SIRT2SIRT1SIRT3
SCHEMBL8190935 0.80 NR4A2 (0.60) NR1H4MEN1KMT2ASPHK2
SCHEMBL4883970 0.80 NR1H4 (0.53) F10NR1H4PDK1PDK2PDK3
SCHEMBL5249717 0.78 NR1H4 (0.65) NR1H4PDK1PDK2PDK3PDK4
SCHEMBL3999277 0.78 F10 (0.50) F10NR1H4PDK1PDK2PDK3
SCHEMBL28390021 0.77 MEN1 (0.71) NR1H4PDK1PDK2PDK3PDK4
SCHEMBL3919608 0.76 DHODH (0.78) NR1H4PDK1PDK2PDK3PDK4
SCHEMBL8119011 0.76 SIRT2 (0.64) NR1H4PDK1PDK2PDK3PDK4
SCHEMBL10599853 0.76 MEN1 (0.79) NR1H4PDK1PDK2PDK3PDK4
SCHEMBL8411917 0.75 POLB (0.62) SPHK2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 US disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 US disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 US disclosed
WO-2008073623-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-06-19 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-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 F10 2437/4885NR1H4 250/4885PDK1 1125/4885

“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.