SCHEMBL20734837

SCHEMBL20734837

O=C1C=C(OCc2cccc3ccccc23)[C@H](Cc2ccccc2)N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
FFAR1 O14842 1/20 0.42
AKR1B1 P15121 1/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PARP10 Q53GL7 1/20 0.39
CYP2D6 P10635 1/20 0.39
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
PIN1 Q13526 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
SLC1A3 P43003 1/20 0.36

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
SCHEMBL20734918 0.89 AKR1B1 (0.42) L3MBTL1FFAR1AKR1B1MEN1KMT2A
SCHEMBL20734917 0.89 AKR1B1 (0.42) L3MBTL1FFAR1AKR1B1MEN1KMT2A
SCHEMBL20734897 0.82 PLA2G10 (0.39) MEN1KMT2AALDH1A1GAA
SCHEMBL20734891 0.82 PLA2G10 (0.39) MEN1KMT2AALDH1A1GAA
SCHEMBL20734913 0.82 PARP15 (0.40) KMT2AALDH1A1PARP10
SCHEMBL20734916 0.82 PARP15 (0.40) KMT2AALDH1A1PARP10
SCHEMBL20734844 0.82 CNR2 (0.39) FFAR1AKR1B1MEN1KMT2AMAPT
SCHEMBL20734845 0.82 CNR2 (0.39) FFAR1AKR1B1MEN1KMT2AMAPT
SCHEMBL24333190 0.80 CYP2D6 (0.36) FFAR1AKR1B1MEN1KMT2AMAPT
SCHEMBL20734964 0.80 CNR1 (0.38) L3MBTL1FFAR1AKR1B1MEN1KMT2A

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 8 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
EP-3643311-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Joekai Biotech. LLC (CN) 2020-04-29 EP 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
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

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 L3MBTL1 3416/4885FFAR1 115/4885AKR1B1 1502/4885
US-11332440-B2 4-oxo-alkylated tetramic acid compound, and preparation method thereof PSEN1, PSEN2, APP L3MBTL1 2697/4885FFAR1 324/4885AKR1B1 335/4885
US-20200181081-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, AND PREPARATION METHOD THEREOF PSEN1, PSEN2, APP L3MBTL1 2697/4885FFAR1 324/4885AKR1B1 335/4885
US-20200361868-A1 4-OXO-ALKYLATED TETRAMIC ACID COMPOUND, PREPARATION METHOD AND USE THEREOF HTT, PARK7, PSEN1 L3MBTL1 3416/4885FFAR1 115/4885AKR1B1 1502/4885

“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.