SCHEMBL31260331

SCHEMBL31260331

CCCCC(CC)COC(=O)CCSc1ccc(CN2CCCC2)cc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MAPK1 P28482 3/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TDP1 Q9NUW8 3/20 0.44
▸ CYP3A4 P08684 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALDH1A1 P00352 7/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ GSTP1 P09211 2/20 0.36
▸ GSTM2 P28161 2/20 0.36
▸ CA2 P00918 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
SCHEMBL31260451 0.94 SMN1; SMN2 (0.47) L3MBTL1MAPTMAPK1NPSR1TDP1
SCHEMBL31260341 0.88 TSHR (0.45) MAPK1TDP1CYP3A4TSHRATM
SCHEMBL31260443 0.86 CYP3A4 (0.43) MAPK1TDP1CYP3A4TSHRATM
SCHEMBL31260295 0.84 CYP3A4 (0.43) MAPTMAPK1TDP1CYP3A4TSHR
SCHEMBL10239305 0.82 CYP3A4 (0.46) L3MBTL1MAPTMAPK1TDP1CYP3A4
SCHEMBL31260302 0.81 TSHR (0.45) MAPTMAPK1TDP1CYP3A4TSHR
SCHEMBL1390827 0.80 ALDH1A1 (0.46) MAPTMAPK1TDP1CYP3A4TSHR
SCHEMBL31260338 0.80 CYP3A4 (0.42) MAPK1TDP1CYP3A4TSHRATM
SCHEMBL31260336 0.80 CYP3A4 (0.42) MAPK1TDP1CYP3A4TSHRATM
SCHEMBL31260306 0.79 ALDH1A1 (0.38) L3MBTL1MAPTTDP1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4716685-A1 IMIDAZO[4,5-C]PYRIDINE COMPOUNDS FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2026-04-01 — — EP disclosed
US-20260070906-A1 IMIDAZO[4,5-C]PYRIDINE COMPOUNDS FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2026-03-12 — — US disclosed
WO-2024240726-A1 IMIDAZO[4,5-C]PYRIDINE COMPOUNDS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2024-11-28 — — WO 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-20260070906-A1 IMIDAZO[4,5-C]PYRIDINE COMPOUNDS FOR THE TREATMENT OF CANCER TLR1, TLR6, TLR8 L3MBTL1 1663/4885MAPT 4827/4885MAPK1 565/4885

“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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