SCHEMBL3815365

SCHEMBL3815365

O=[N+]([O-])c1ccc(Cn2cc(I)c3c(Cl)ncnc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 14/20 0.48
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ ADK P55263 1/20 0.41
▸ DBH P09172 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ TGM2 P21980 1/20 0.38

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
SCHEMBL3817538 0.87 SLC29A1 (0.47) SLC29A1KMT2AMEN1LMNAADK
SCHEMBL18342054 0.80 MEN1 (0.51) SLC29A1KMT2AMEN1ADK
SCHEMBL15708559 0.80 CA12 (0.44) SLC29A1KMT2AMEN1ADKMAPT
SCHEMBL16236981 0.74 KDM4C (0.41) SLC29A1KMT2AMEN1LMNAADK
SCHEMBL4014438 0.72 ADK (0.43) SLC29A1KMT2AMEN1ADK
SCHEMBL7701985 0.72 SLC29A1 (0.44) SLC29A1KMT2AMEN1LMNAADK
SCHEMBL7704315 0.72 SLC29A1 (0.44) SLC29A1KMT2AMEN1LMNAADK
SCHEMBL14617855 0.71 FGFR1 (0.47) KMT2AMEN1ALDH1A1MAPT
SCHEMBL29503417 0.71 ADK (0.46) SLC29A1KMT2AMEN1ADK
SCHEMBL16236999 0.71 ADK (0.46) SLC29A1KMT2AMEN1ADK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730148-A4 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS ABBOTT LAB (US) 2009-08-19 — — EP disclosed
EP-1730148-A2 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS Abbott Laboratories (US) 2006-12-13 — — EP disclosed
US-20060025383-A1 Aminobenzoxazoles as therapeutic agents ABBOTT LABORATORIES 2006-02-02 — — US disclosed
WO-2005074603-A2 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS ABBOTT LABORATORIES (US) 2005-08-18 — — 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-20060025383-A1 Aminobenzoxazoles as therapeutic agents ABL1, MAP3K19, MAP3K20 SLC29A1 1901/4885KMT2A 261/4885MEN1 2995/4885

“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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