SCHEMBL22344483

SCHEMBL22344483

O=C1CN(c2ncc(-c3nc4ccncc4n3-c3ccccc3Cl)cn2)CCN1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 18/20 0.68
▸ KCNH2 Q12809 2/20 0.48

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
SCHEMBL16047677 0.85 AOC3 (0.82) AOC3KCNH2
SCHEMBL30026182 0.85 AOC3 (0.82) AOC3KCNH2
SCHEMBL30026425 0.81 AOC3 (1.00) AOC3KCNH2
SCHEMBL16048595 0.81 AOC3 (1.00) AOC3KCNH2
SCHEMBL16052787 0.71 AOC3 (1.00) AOC3KCNH2
SCHEMBL16052882 0.70 KCNH2 (0.68) AOC3KCNH2
SCHEMBL16053138 0.70 AOC3 (1.00) AOC3KCNH2
SCHEMBL16067936 0.67 AOC3 (0.84) AOC3KCNH2
SCHEMBL25310063 0.67 AOC3 (0.44) AOC3
SCHEMBL19117494 0.67 AOC3 (0.49) AOC3KCNH2

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-20200262835-A1 COMPOUNDS PROXIMAGEN, LLC (US) 2020-08-20 — — US claimed

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-20200262835-A1 COMPOUNDS QSOX1, AOX1, EPX AOC3 27/4885KCNH2 642/4885

“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.

Send feedback