SCHEMBL22449437

SCHEMBL22449437

O=[N+]([O-])c1ccc(-c2nc3ccccc3c3cc4ccccn4c23)cc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 1/20 0.41
▸ KMT2A Q03164 8/20 0.39
▸ MEN1 O00255 7/20 0.39
▸ MAPT P10636 5/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TNK2 Q07912 4/20 0.37
▸ CHEK2 O96017 2/20 0.36
▸ RPS6KA3 P51812 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ PDE4B Q07343 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ ABCB1 P08183 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35

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
SCHEMBL17620582 0.86 RAD51 (0.47) CFTRKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL17620557 0.80 KDM4E (0.40) MAPTSMN1; SMN2RAB9AALDH1A1NPC1
SCHEMBL17620562 0.80 RAB9A (0.40) MAPTSMN1; SMN2RAB9AALDH1A1NPC1
SCHEMBL22449448 0.79 KDM4E (0.40) KMT2AMEN1MAPTSMN1; SMN2TNK2
SCHEMBL22449438 0.77 RAD51 (0.50) KMT2AMEN1MAPTSMN1; SMN2TNK2
SCHEMBL22449433 0.77 MEN1 (0.49) KMT2AMEN1TNK2ALDH1A1
SCHEMBL17620569 0.77 CYP19A1 (0.47) KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL17620578 0.77 TDP1 (0.49) MAPTSMN1; SMN2RAB9AALDH1A1NPC1
SCHEMBL21656455 0.77 RAD51 (0.38) KMT2AMEN1MAPTSMN1; SMN2RAB9A
SCHEMBL17620587 0.77 KDM4E (0.49) KMT2AMEN1SMN1; SMN2RAB9AMAPK1

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-10787448-B2 Indolizino [3,2-C] quinoline-based fluorescent probe SEOUL NATIONAL UNIVERSITY R & DB FOUNDATION (KR) 2020-09-29 — — 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-10787448-B2 Indolizino [3,2-C] quinoline-based fluorescent probe DNA2, IRF3, DDB1 CFTR 4126/4885KMT2A 3767/4885MEN1 3101/4885

“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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