SCHEMBL6333513

SCHEMBL6333513

O=CC(=C/c1cccc(Cl)c1)/C(C=O)=C\c1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 2/20 0.54
▸ CYP1A2 P05177 3/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CHRM5 P08912 1/20 0.48
▸ KMT2A Q03164 3/20 0.46
▸ POLB P06746 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ PKM P14618 1/20 0.46
▸ MAOB P27338 3/20 0.45
▸ GRIN2D O15399 2/20 0.43
▸ GRIN3B O60391 2/20 0.43
▸ GRIN1 Q05586 2/20 0.43
▸ GRIN2A Q12879 2/20 0.43
▸ GRIN2B Q13224 2/20 0.43
▸ GRIN2C Q14957 2/20 0.43
▸ GRIN3A Q8TCU5 2/20 0.43
▸ AKR1C3 P42330 1/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ CHAT P28329 1/20 0.41

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
SCHEMBL6333516 1.00 FBP1 (0.54) FBP1CYP1A2CYP2C9CHRM5KMT2A
SCHEMBL38654763 0.81 FBP1 (0.51) FBP1CYP1A2CYP2C9CHRM5KMT2A
SCHEMBL40399 0.76 — —
SCHEMBL29672621 0.76 — —
SCHEMBL14198038 0.75 FBP1 (0.53) FBP1CYP1A2CYP2C9CHRM5KMT2A
SCHEMBL11246694 0.74 CYP1A2 (0.55) FBP1CYP1A2CYP2C9CHRM5KMT2A
SCHEMBL6333730 0.74 HSD17B10 (0.54) FBP1CYP1A2CYP2C9ALDH1A1MAOB
SCHEMBL6333729 0.74 HSD17B10 (0.54) FBP1CYP1A2CYP2C9ALDH1A1MAOB
SCHEMBL18530648 0.73 CYP1A2 (0.53) FBP1CYP1A2CYP2C9CHRM5KMT2A
SCHEMBL3170838 0.73 CYP1A2 (0.58) FBP1CYP1A2CYP2C9CHRM5KMT2A

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
US-6949682-B2 Cinnamaldehyde derivatives inhibiting growth of tumor cell and regulating cell cycle, preparations and pharmaceutical compositions thereof KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2005-09-27 — — US claimed
US-20040254196-A1 Cinnamaldehyde derivatives inhibiting growth of tumor cell and regulating cell cycle, preparations and pharmaceutical compositions thereof KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2004-12-16 — — US claimed
US-6949682-B2 Cinnamaldehyde derivatives inhibiting growth of tumor cell and regulating cell cycle, preparations and pharmaceutical compositions thereof KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2005-09-27 — — US disclosed
US-20040254196-A1 Cinnamaldehyde derivatives inhibiting growth of tumor cell and regulating cell cycle, preparations and pharmaceutical compositions thereof KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2004-12-16 — — US 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-20040254196-A1 Cinnamaldehyde derivatives inhibiting growth of tumor cell and regulating cell cycle, preparations and pharmaceutical compositions thereof CCNI, CDC25C, CDC25B FBP1 3041/4885CYP1A2 707/4885CYP2C9 1047/4885

“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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