SCHEMBL13412869

SCHEMBL13412869

NC(=O)c1ccc2cc(-c3cccc(N=O)c3)cn2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.36
▸ DHODH Q02127 3/20 0.35
▸ AOC3 Q16853 2/20 0.33
▸ CHEK2 O96017 2/20 0.33
▸ MKNK1 Q9BUB5 4/20 0.33
▸ MKNK2 Q9HBH9 4/20 0.33
▸ CCNT1 O60563 1/20 0.32
▸ CCND1 P24385 1/20 0.32
▸ CCNC P24863 1/20 0.32
▸ CDK8 P49336 1/20 0.32
▸ CDK7 P50613 1/20 0.32
▸ CDK9 P50750 1/20 0.32
▸ CCNH P51946 1/20 0.32
▸ MNAT1 P51948 1/20 0.32
▸ CDK6 Q00534 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ BRD9 Q9H8M2 1/20 0.32
▸ ERN1 O75460 1/20 0.32
▸ HPGDS O60760 1/20 0.32
▸ PARP1 P09874 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
SCHEMBL13412870 0.84 NR4A2 (0.39) NR4A2MKNK1MKNK2CDK8BRD4
SCHEMBL14864456 0.81 DHODH (0.51) NR4A2DHODHBRD4BRD9PARP1
SCHEMBL23769123 0.78 MKNK1 (0.51) DHODHAOC3CHEK2MKNK1MKNK2
SCHEMBL13412871 0.77 SLC6A7 (0.36) AOC3
SCHEMBL1852275 0.77 TSHR (0.54) MAPT
SCHEMBL1848238 0.70 MAP4K4 (0.55) CHEK2MKNK1MKNK2BRD4BRD9
SCHEMBL1565391 0.69 PARP1 (0.55) PARP1PARP15PARP10MAPT
SCHEMBL29551821 0.69 PARP1 (0.55) PARP1PARP15PARP10MAPT
SCHEMBL7169894 0.69 EGFR (0.46) DHODHNPC1MAPTRAB9A
SCHEMBL13179896 0.64 MAOA (0.44) NPC1MAPTRAB9A

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-20100098634-A1 Imaging Agents Useful for Identifying AD Pathology SIEMENS MEDICAL SOLUTIONS USA, INC. 2010-04-22 — — 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-20100098634-A1 Imaging Agents Useful for Identifying AD Pathology APP, APBA1, PYGB NR4A2 3183/4885DHODH 3126/4885AOC3 1104/4885

“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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