SCHEMBL437515

SCHEMBL437515

CC(C)c1nnc(C2CCC(C(=O)O)NC2)o1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 2/20 0.34
GRIA2 P42262 2/20 0.34
GRIA3 P42263 2/20 0.34
GRIA4 P48058 2/20 0.34
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
GRIK3 Q13003 1/20 0.34
GRIK4 Q16099 1/20 0.34
GRIK5 Q16478 1/20 0.34
ATM Q13315 1/20 0.32
EPHX2 P34913 2/20 0.32
ENPP2 Q13822 1/20 0.31

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
SCHEMBL408945 0.84 LIPE (0.33) ATMENPP2
SCHEMBL407984 0.79 ENPP2 (0.35) ATMEPHX2ENPP2
SCHEMBL408780 0.79 ENPP2 (0.35) ATMEPHX2ENPP2
SCHEMBL407401 0.73 EPHX2 (0.34) EPHX2
SCHEMBL407409 0.72 TLR8 (0.40)
Bromide SCHEMBL437843 0.71 TLR8 (0.39)
SCHEMBL441068 0.69 PKM (0.37) EPHX2ENPP2
SCHEMBL17911333 0.69 EPHX2 (0.35) EPHX2ENPP2
SCHEMBL15490002 0.69 CYP2C19 (0.41) ATM
SCHEMBL407920 0.68 KDM1A (0.33) ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT GRIA1 478/4885GRIA2 417/4885GRIA3 519/4885

“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.