SCHEMBL17251600

SCHEMBL17251600

COc1cc(/C=C\c2cc(O)c(OC)c(N/C=C\C(=O)c3ccc(C)cc3)c2)cc(OC)c1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.65
▸ CA2 P00918 3/20 0.65
▸ ABCG2 Q9UNQ0 1/20 0.54
▸ CXCL12 P48061 1/20 0.54
▸ KRAS P01116 6/20 0.53
▸ MAPT P10636 3/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ ALDH1A1 P00352 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ ATM Q13315 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ HTT P42858 1/20 0.50
▸ CYP1A1 P04798 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C8 P10632 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP1B1 Q16678 1/20 0.49
▸ TUBB4A P04350 3/20 0.49

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
SCHEMBL17251596 0.93 CA1 (0.71) CA1CA2ABCG2CXCL12KRAS
SCHEMBL17237422 0.93 ABCG2 (0.55) CA1CA2ABCG2KRASMAPT
SCHEMBL17237423 0.93 ABCG2 (0.55) CA1CA2ABCG2KRASMAPT
SCHEMBL17237026 0.92 KRAS (0.65) CA1CA2ABCG2CXCL12KRAS
SCHEMBL17237029 0.92 KRAS (0.65) CA1CA2ABCG2CXCL12KRAS
SCHEMBL17237088 0.91 KRAS (0.66) CA1CA2ABCG2CXCL12KRAS
SCHEMBL17237414 0.91 KRAS (0.66) CA1CA2ABCG2KRASMAPT
SCHEMBL17237417 0.91 KRAS (0.66) CA1CA2ABCG2KRASMAPT
SCHEMBL17236856 0.91 CXCL12 (0.55) CA1CA2ABCG2CXCL12KRAS
SCHEMBL17237090 0.91 KRAS (0.66) CA1CA2ABCG2CXCL12KRAS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487482-B2 3,4,5-trimethoxystyrylarylaminopropenones as potential anticancer agents COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2016-11-08 — — US disclosed
US-20150322009-A1 NOVEL 3,4,5-TRIMETHOXYSTYRYLARYLAMINOPROPENONES AS POTENTIAL ANTICANCER AGENTS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-11-12 — — 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-20150322009-A1 NOVEL 3,4,5-TRIMETHOXYSTYRYLARYLAMINOPROPENONES AS POTENTIAL ANTICANCER AGENTS MCL1, HCCS, CASP3 CA1 4408/4885CA2 4130/4885ABCG2 149/4885

“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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