SCHEMBL17237361

SCHEMBL17237361

COc1cc(C=Cc2cc(O)c(OC)c(N/C=C\C(=O)c3ccccc3)c2)cc(OC)c1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ KLF5 Q13887 1/20 0.56
▸ ABCB1 P08183 3/20 0.55
▸ ABCG2 Q9UNQ0 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.52
▸ TNFRSF1A P19438 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ KRAS P01116 6/20 0.51
▸ CA1 P00915 3/20 0.51
▸ CA2 P00918 3/20 0.51
▸ CYP1A1 P04798 2/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ CYP1B1 Q16678 2/20 0.50
▸ CYP2C8 P10632 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50

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
SCHEMBL17236689 1.00 MEN1 (0.56) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17237359 1.00 MEN1 (0.56) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17236691 1.00 MEN1 (0.56) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17236790 0.93 MEN1 (0.60) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17236788 0.93 MEN1 (0.60) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17237399 0.93 MEN1 (0.60) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17237396 0.93 MEN1 (0.60) MEN1NPC1PKMRAB9AKMT2A
SCHEMBL17237422 0.91 ABCG2 (0.55) MEN1KMT2AABCB1ABCG2ALDH1A1
SCHEMBL17237423 0.91 ABCG2 (0.55) MEN1KMT2AABCB1ABCG2ALDH1A1
SCHEMBL17237235 0.91 TUBB1 (0.56) MEN1KMT2AABCB1ABCG2TNFRSF1A

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
EP-2942345-B1 3,4,5-TRIMETHOXYSTYRYLARYLAMINOPROPENONES FOR THE TREATMENT OF CANCER COUNCIL SCIENT IND RES (IN) 2018-03-28 — — EP disclosed
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
EP-2942345-A1 3,4,5-TRIMETHOXYSTYRYLARYLAMINOPROPENONES for the treatment of cancer Council of Scientific and Industrial Research (IN) 2015-11-11 — — EP 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 MEN1 692/4885NPC1 1040/4885PKM 2505/4885

“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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