SCHEMBL7261530

SCHEMBL7261530

COc1ccccc1C1=C2C=CC(=N2)C=C2C=CC(=N2)C=C2C=CC(=N2)C=C2C=CC1=N2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.35
▸ CCNB2 O95067 1/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ CCNB1 P14635 1/20 0.34
▸ GSK3A P49840 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ CDK5 Q00535 1/20 0.34
▸ CDK5R1 Q15078 1/20 0.34
▸ CCNB3 Q8WWL7 1/20 0.34
▸ APP P05067 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ SMN1; SMN2 Q16637 5/20 0.33
▸ RAB9A P51151 4/20 0.33
▸ HPGD P15428 3/20 0.33
▸ TP53 P04637 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ KMT2A Q03164 3/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.31

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
SCHEMBL10570890 0.83 ALDH1A1 (0.44) ALDH1A1CCNB2CDK1CCNB1GSK3A
SCHEMBL10423763 0.77 ALDH1A1 (0.36) ALDH1A1CCNB2CDK1CCNB1GSK3A
SCHEMBL2226184 0.76 CYP1A2 (0.32) ALDH1A1CYP1A2CYP3A4
SCHEMBL8189724 0.74 KDM4E (0.34) ALDH1A1CDK1CCNB1GSK3BCDK5
SCHEMBL15919248 0.71 CCNB2 (0.31) CCNB2CDK1CCNB1GSK3AGSK3B
SCHEMBL8906766 0.71 — —
SCHEMBL7258064 0.68 — —
SCHEMBL17391664 0.68 PTGS2 (0.38) PTGS2
SCHEMBL7257319 0.67 — —
SCHEMBL5134033 0.67 — —

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 ALDH1A1 2976/4885CCNB2 1385/4885CDK1 3500/4885

“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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