SCHEMBL3812963

SCHEMBL3812963

COc1cc(Cn2cc(I)c3c(Cl)ncnc32)cc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 4/20 0.47
▸ HSP90AB1 P08238 3/20 0.47
▸ ADK P55263 4/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ PDE5A O76074 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ SLC29A1 Q99808 1/20 0.35
▸ DHFR P00374 1/20 0.35
▸ SLC2A1 P11166 1/20 0.35
▸ YTHDC1 Q96MU7 1/20 0.35
▸ ERBB2 P04626 1/20 0.35
▸ PTGS2 P35354 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
SCHEMBL3822608 0.86 DYRK3 (0.46) HSP90AA1HSP90AB1ADKKDM4EPDE5A
SCHEMBL18342054 0.77 MEN1 (0.51) ADKMEN1KMT2ASLC29A1
SCHEMBL3396153 0.77 HSP90AA1 (0.69) HSP90AA1HSP90AB1KDM4EMEN1KMT2A
SCHEMBL16235957 0.76 ADK (0.40) ADKKDM4EMEN1KMT2ASLC29A1
SCHEMBL29503417 0.73 ADK (0.46) ADKMEN1KMT2ASLC29A1
SCHEMBL16236999 0.73 ADK (0.46) ADKMEN1KMT2ASLC29A1
SCHEMBL16236547 0.73 ADK (0.47) ADKMEN1KMT2ASLC29A1
SCHEMBL23630551 0.71 ADK (0.43) ADKMEN1KMT2ASLC29A1
SCHEMBL16236531 0.71 ADK (0.44) ADKMEN1KMT2ASLC29A1
SCHEMBL16236981 0.71 KDM4C (0.41) ADKMEN1ALDH1A1KMT2ASLC29A1

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 HSP90AA1 1875/4885HSP90AB1 1273/4885ADK 144/4885

“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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