SCHEMBL7257624

SCHEMBL7257624

COc1ccc(-c2c3nc(cc4ccc([nH]4)c(-c4ccc(NC(C)=O)cc4)c4nc(cc5ccc2[nH]5)C(O)C4O)C=C3)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 1/20 0.42
▸ MTNR1B P49286 1/20 0.42
▸ STAT3 P40763 1/20 0.40
▸ STAT1 P42224 1/20 0.40
▸ ITK Q08881 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ ACHE P22303 1/20 0.37
▸ KCNQ2 O43526 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ DYRK1A Q13627 1/20 0.35
▸ DYRK1B Q9Y463 1/20 0.35
▸ BRAF P15056 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 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
SCHEMBL7258044 0.90 STAT3 (0.49) MTNR1AMTNR1BSTAT3STAT1ITK
SCHEMBL7257245 0.86 STAT3 (0.44) STAT3STAT1KDM4EALDH1A1HPGD
SCHEMBL5011955 0.78 STAT3 (0.55) STAT3STAT1KCNQ2TNIKKDM4E
SCHEMBL4266558 0.78 STAT3 (0.63) STAT3STAT1KDM4EALDH1A1SMN1; SMN2
SCHEMBL9590030 0.76 STAT3 (0.60) STAT3STAT1KDM4EALDH1A1SMN1; SMN2
SCHEMBL7257922 0.75 STAT3 (0.37) MTNR1AMTNR1BSTAT3STAT1ITK
SCHEMBL8996959 0.75 STAT3 (0.59) STAT3STAT1KDM4EALDH1A1SMN1; SMN2
SCHEMBL14629698 0.75 STAT3 (0.41) STAT3STAT1KCNQ2KDM4EALDH1A1
SCHEMBL2790794 0.75 STAT3 (0.47) MTNR1AMTNR1BSTAT3STAT1ITK
SCHEMBL28476967 0.74 STAT3 (0.46) MTNR1AMTNR1BSTAT3STAT1TNIK

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 MTNR1A 2928/4885MTNR1B 2441/4885STAT3 3257/4885

“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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