SCHEMBL4874500

SCHEMBL4874500

O=C(Nc1cccc(OCc2ccccc2)c1)C(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.58
PDK2 Q15119 1/20 0.58
PDK3 Q15120 1/20 0.58
PDK4 Q16654 1/20 0.58
MAOB P27338 2/20 0.58
F10 P00742 2/20 0.55
MRGPRX4 Q96LA9 2/20 0.53
NR1H4 Q96RI1 2/20 0.53
MGLL Q99685 1/20 0.53
PPARA Q07869 1/20 0.53
NR4A2 P43354 2/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RXFP1 Q9HBX9 1/20 0.51
SENP5 Q96HI0 1/20 0.51
SENP2 Q9HC62 1/20 0.51
SENP1 Q9P0U3 1/20 0.51
LRRK2 Q5S007 1/20 0.50

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
SCHEMBL4255007 0.85 PPIA (0.64) PDK1PDK2PDK3PDK4MAOB
SCHEMBL13956782 0.84 MEN1 (0.69) PDK1PDK2PDK3PDK4MAOB
SCHEMBL4884248 0.81 PDK1 (0.56) PDK1PDK2PDK3PDK4MAOB
SCHEMBL21497178 0.80 MAOB (0.71) PDK1PDK2PDK3PDK4MAOB
SCHEMBL8148879 0.80 NR1H4 (0.71) MAOBMRGPRX4NR1H4NR4A2NPC1
SCHEMBL11550139 0.78 NR1H4 (0.81) MAOBNR1H4NR4A2NPC1RAB9A
SCHEMBL14086749 0.78 PDK1 (0.53) PDK1PDK2PDK3PDK4MAOB
SCHEMBL5104712 0.77 MEN1 (0.64) PDK1PDK2PDK3PDK4MAOB
SCHEMBL5249717 0.76 NR1H4 (0.65) PDK1PDK2PDK3PDK4MAOB
SCHEMBL28390021 0.75 MEN1 (0.71) PDK1PDK2PDK3PDK4MAOB

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 PDK1 1125/4885PDK2 1595/4885PDK3 1176/4885

“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.