SCHEMBL4295243

SCHEMBL4295243

CC(C)(C)OC(=O)NCCNC(=O)c1ccc(OCC(F)(F)F)nc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.61
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
CYP2J2 P51589 1/20 0.59
GABRA5 P31644 1/20 0.56
DGAT1 O75907 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.55
KCNH2 Q12809 3/20 0.53
SCN9A Q15858 3/20 0.53
SCN5A Q14524 2/20 0.53
TRPV1 Q8NER1 1/20 0.52
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
MAPT P10636 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
SCHEMBL13624979 0.83 EPHX2 (0.66) EPHX2CYP2C9CYP2C19CYP2J2DGAT1
SCHEMBL4251142 0.82 EPHX2 (0.67) EPHX2CYP2C9CYP2C19CYP2J2DGAT1
SCHEMBL13702303 0.81 L3MBTL1 (0.65) EPHX2CYP2C9CYP2C19CYP2J2GABRA5
SCHEMBL4178518 0.81 EPHX2 (0.73) EPHX2CYP2C9CYP2C19CYP2J2DGAT1
Hydrochloric Acid SCHEMBL4253231 0.81 EPHX2 (0.66) EPHX2CYP2C9CYP2C19CYP2J2DGAT1
SCHEMBL20289570 0.80 MEN1 (0.57) GABRA5DGAT1L3MBTL1
SCHEMBL4298673 0.79 DGAT1 (0.72) EPHX2CYP2C9CYP2C19CYP2J2GABRA5
SCHEMBL26494561 0.79 GABRA5 (0.51) GABRA5DGAT1MAPT
SCHEMBL13701755 0.79 L3MBTL1 (0.65) EPHX2CYP2C9CYP2C19CYP2J2GABRA5
SCHEMBL31498883 0.79 L3MBTL1 (0.65) EPHX2CYP2C9CYP2C19CYP2J2DGAT1

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-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 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-20090286791-A1 Amide Compounds DLAT, DGAT2, DGAT1 EPHX2 1912/4885CYP2C9 2594/4885CYP2C19 2952/4885

“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.