SCHEMBL7257922

SCHEMBL7257922

COc1ccc(-c2c3nc(cc4ccc([nH]4)c(-c4ccc(NC(C)=O)cc4)c4nc(cc5[nH]c2c(O)c5O)C=C4)CC3)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.37
▸ STAT1 P42224 1/20 0.37
▸ ITK Q08881 1/20 0.37
▸ MTNR1A P48039 1/20 0.36
▸ MTNR1B P49286 1/20 0.36
▸ FYN P06241 1/20 0.33
▸ F3 P13726 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ DYRK1B Q9Y463 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ PAX8 Q06710 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ KCNQ2 O43526 1/20 0.32
▸ SLC2A1 P11166 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7259976 0.88 STAT3 (0.40) STAT3STAT1ABCG2SMN1; SMN2ALDH1A1
SCHEMBL7262946 0.88 STAT3 (0.40) STAT3STAT1ABCG2SMN1; SMN2ALDH1A1
SCHEMBL7257919 0.86 MTNR1A (0.41) ITKMTNR1AMTNR1BFYNACHE
SCHEMBL7258044 0.84 STAT3 (0.49) STAT3STAT1ITKMTNR1AMTNR1B
SCHEMBL7259678 0.78 ITK (0.40) ITKMTNR1AMTNR1BFYNACHE
SCHEMBL7257624 0.75 MTNR1A (0.42) STAT3STAT1ITKMTNR1AMTNR1B
SCHEMBL5011955 0.74 STAT3 (0.55) STAT3STAT1DYRK1AABCG2MAPT
SCHEMBL4266558 0.72 STAT3 (0.63) STAT3STAT1ABCG2MAPTSLC2A1
SCHEMBL7260982 0.72 ALDH1A1 (0.40) MAPTSMN1; SMN2HSP90AA1KDM4EALDH1A1
SCHEMBL9590030 0.70 STAT3 (0.60) STAT3STAT1ABCG2MAPTSLC2A1

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
US-20030203888-A1 Chromophores WELLCOME TRUST LIMITED, THE (GB) 2003-10-30 — — US disclosed
EP-1294726-A2 IMPROVEMENTS IN AND RELATING TO CHROMOPHORES Catalyst Biomedica Ltd (GB) 2003-03-26 — — EP disclosed
WO-2002000662-A1 IMPROVEMENTS IN AND RELATING TO CHROMOPHORES CATALYST BIOMEDICA LIMITED (GB) 2002-01-03 — — 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-20030203888-A1 Chromophores HCCS, PPOX, HMBS STAT3 3257/4885STAT1 4092/4885ITK 3102/4885

“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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