SCHEMBL25746167

SCHEMBL25746167

CC(C)n1cc(-n2cccn2)cc([N+](=O)[O-])c1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.36
▸ MAPT P10636 8/20 0.36
▸ KMT2A Q03164 8/20 0.36
▸ MEN1 O00255 7/20 0.36
▸ POLB P06746 1/20 0.36
▸ LMNA P02545 4/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ RAB9A P51151 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ KDM5B Q9UGL1 2/20 0.35
▸ HTT P42858 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ DCTPP1 Q9H773 1/20 0.34

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
SCHEMBL25745858 0.80 MAPT (0.39) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL24007323 0.79 KDM4E (0.42) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL24007289 0.79 POLB (0.36) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL24007329 0.76 HCRTR1 (0.38) ALDH1A1POLBMDM2
SCHEMBL24816287 0.76 POLB (0.35) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL25746166 0.72 KDM5B (0.34) ALDH1A1MAPTKMT2APOLBKDM5B
SCHEMBL24813442 0.72 POLB (0.33) ALDH1A1MAPTKMT2APOLBKDM5B
SCHEMBL27853895 0.71 MAPT (0.48) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL16150794 0.71 ALDH1A1 (0.47) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL25746099 0.70 LMNA (0.40) ALDH1A1MAPTKMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2023-08-24 — — US disclosed
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors AJAX THERAPEUTICS, INC. (US) 2023-07-04 — — 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 (2 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-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B ALDH1A1 3735/4885MAPT 4844/4885KMT2A 462/4885
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors JAK2, JAK3, STAT5B ALDH1A1 3735/4885MAPT 4844/4885KMT2A 462/4885

“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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