SCHEMBL20734898

SCHEMBL20734898

COc1ccc(OC)c(COC2=CC(=O)N[C@H]2Cc2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
IDO1 P14902 2/20 0.41
HSD17B10 Q99714 1/20 0.40
TACR1 P25103 1/20 0.39
MTNR1B P49286 1/20 0.39
MMP1 P03956 1/20 0.39
MMP3 P08254 1/20 0.39
MMP9 P14780 1/20 0.39
TP53 P04637 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
ABCB1 P08183 1/20 0.39

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
SCHEMBL20734899 1.00 TSHR (0.45) TSHRMEN1POLBKMT2AIDO1
SCHEMBL24333187 0.88 MEN1 (0.42) TSHRMEN1POLBKMT2AIDO1
SCHEMBL21929341 0.84 MAOB (0.48) IDO1MMP1MMP3MMP9ABCB1
SCHEMBL20734910 0.84 MMP1 (0.48) MEN1POLBKMT2AMMP1MMP3
SCHEMBL20734821 0.81 ABCB1 (0.52) MEN1KMT2AABCB1
SCHEMBL20734820 0.81 ABCB1 (0.52) MEN1KMT2AABCB1
SCHEMBL20734891 0.78 PLA2G10 (0.39) MEN1POLBKMT2A
SCHEMBL20734897 0.78 PLA2G10 (0.39) MEN1POLBKMT2A
SCHEMBL20734918 0.77 AKR1B1 (0.42) MEN1KMT2AMMP1MMP3MMP9
SCHEMBL20734917 0.77 AKR1B1 (0.42) MEN1KMT2AMMP1MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332440-B2 4-oxo-alkylated tetramic acid compound, and preparation method thereof BEIJING JOEKAI BIOTECH. LLC (CN) 2022-05-17 US disclosed
US-11130733-B2 4-OXO-alkylated tetramic acid compound, preparation method and use thereof BEIJING JOEKAI BIOTECH. LLC (CN) 2021-09-28 US disclosed
US-20200361868-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, PREPARATION METHOD AND USE THEREOF BEIJING JOEKAI BIOTECH. LLC (CN) 2020-11-19 US disclosed
US-20200181081-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, AND PREPARATION METHOD THEREOF BEIJING JOEKAI BIOTECH. LLC (CN) 2020-06-11 US disclosed
EP-3647306-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND AND PREPARATION METHOD THEREFOR Beijing Joekai Biotech. LLC (CN) 2020-05-06 EP disclosed
WO-2019029274-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND AND PREPARATION METHOD THEREFOR 北京卓凯生物技术有限公司 2019-02-14 WO disclosed
WO-2019029273-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 北京卓凯生物技术有限公司 2019-02-14 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 (4 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-11130733-B2 4-OXO-alkylated tetramic acid compound, preparation method and use thereof HTT, PARK7, PSEN1 TSHR 1337/4885MEN1 2261/4885POLB 1344/4885
US-11332440-B2 4-oxo-alkylated tetramic acid compound, and preparation method thereof PSEN1, PSEN2, APP TSHR 2178/4885MEN1 1113/4885POLB 1828/4885
US-20200181081-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, AND PREPARATION METHOD THEREOF PSEN1, PSEN2, APP TSHR 2178/4885MEN1 1113/4885POLB 1828/4885
US-20200361868-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, PREPARATION METHOD AND USE THEREOF HTT, PARK7, PSEN1 TSHR 1337/4885MEN1 2261/4885POLB 1344/4885

“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.