SCHEMBL15075715

SCHEMBL15075715

Cn1c2c(c(=O)[nH]c1=O)N(CC(N)O)CN2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.35
▸ GFER P55789 1/20 0.32
▸ GRIA1 P42261 2/20 0.30
▸ GRIA2 P42262 2/20 0.30
▸ GRIA4 P48058 2/20 0.30
▸ GRIK5 Q16478 2/20 0.30

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
SCHEMBL15075698 0.80 EPHX2 (0.39) EPHX2GFER
SCHEMBL15075645 0.79 ALDH1A1 (0.39) EPHX2GFER
SCHEMBL19036772 0.79 ALDH1A1 (0.36) —
SCHEMBL18819656 0.75 EPHX2 (0.35) EPHX2GFER
SCHEMBL18819094 0.74 EPHX2 (0.34) EPHX2GFER
SCHEMBL19036508 0.72 KDM4E (0.40) —
SCHEMBL18819443 0.72 EPHX2 (0.41) EPHX2GFER
SCHEMBL18819722 0.70 EPHX2 (0.37) EPHX2GFER
SCHEMBL8952584 0.60 POLB (0.33) EPHX2
SCHEMBL21711061 0.60 PER2 (0.49) —

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-20130165427-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CHEMICAL WARFARE AGENT-INDUCED INJURIES HYDRA BIOSCIENCES, INC. (US) 2013-06-27 — — 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-20130165427-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CHEMICAL WARFARE AGENT-INDUCED INJURIES ELANE, CASP3, MMP8 EPHX2 838/4885GFER 1214/4885GRIA1 3378/4885

“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.

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