SCHEMBL3512196

SCHEMBL3512196

CC(C)=CCOCC(O)CO

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
LMNA P02545 3/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 3/20 0.32
CYP1A2 P05177 2/20 0.32
AGTR1 P30556 1/20 0.32
DUSP3 P51452 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BTN3A1 O00481 1/20 0.31
PLA2G2C Q5R387 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL22492167 0.89 CA1 (0.40) CA1CA2CA7KDM4EBTN3A1
Glycerin SCHEMBL25402485 0.86 ALDH1A1 (0.43) USP2LMNAALDH1A1BTN3A1
SCHEMBL5487437 0.84 ALOX15 (0.49) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL5487441 0.84 ALOX15 (0.49) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL16221425 0.82 KMT2A (0.50) ALDH1A1MEN1KMT2A
SCHEMBL17554321 0.82 KMT2A (0.50) ALDH1A1MEN1KMT2A
SCHEMBL16221418 0.82 KMT2A (0.50) ALDH1A1MEN1KMT2A
SCHEMBL17554293 0.82 KMT2A (0.50) ALDH1A1MEN1KMT2A
SCHEMBL26754534 0.81 CA1 (0.35) CA1CA2CA7
SCHEMBL26754532 0.81 TSHR (0.36) CA1CA2CA7ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114072439-B Curable composition and resin composition for photofabrication comprising same 株式会社可乐丽 2024-05-14 CN disclosed
CN-114981026-A Metal particle composition, method for producing metal particle composition, and paste 株式会社可乐丽 2022-08-30 CN disclosed
CN-114072439-A Curable composition and resin composition for stereolithography comprising same 株式会社可乐丽 2022-02-18 CN disclosed
CN-113661195-A Polymer, oxygen absorber using the same, and curable composition 株式会社可乐丽 2021-11-16 CN disclosed
US-20210163391-A1 COMPOUND CONTAINING UNSATURATED DOUBLE BOND, OXYGEN ABSORBENT USING SAME AND RESIN COMPOSITION KURARAY CO., LTD. (JP) 2021-06-03 US disclosed
EP-3782975-A1 COMPOUND CONTAINING UNSATURATED DOUBLE BOND, OXYGEN ABSORBENT USING SAME AND RESIN COMPOSITION Kuraray Co., Ltd. (JP) 2021-02-24 EP disclosed
US-20170081690-A1 MOENOMYCIN BIOSYNTHESIS-RELATED COMPOSITIONS AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-03-23 US disclosed
US-9115358-B2 Moenomycin biosynthesis-related compositions and methods of use thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-08-25 US disclosed
US-20100279980-A1 MOENOMYCIN BIOSYNTHESIS-RELATED COMPOSITIONS AND METHODS OF USE THEREOF PRESIDENT AND FELLOW OF HARWARD COLLEGE 2010-11-04 US disclosed
WO-2008021367-A2 MOENOMYCIN BIOSYNTHESIS-RELATED COMPOSITIONS AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2008-02-21 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 (3 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-20210163391-A1 COMPOUND CONTAINING UNSATURATED DOUBLE BOND, OXYGEN ABSORBENT USING SAME AND RESIN COMPOSITION ALOX12, ALOX15B, DUOX2 USP2 2547/4885CA1 2252/4885CA2 2639/4885
US-20100279980-A1 MOENOMYCIN BIOSYNTHESIS-RELATED COMPOSITIONS AND METHODS OF USE THEREOF MGAM, GALE, GMDS USP2 2548/4885CA1 4074/4885CA2 4010/4885
US-20170081690-A1 MOENOMYCIN BIOSYNTHESIS-RELATED COMPOSITIONS AND METHODS OF USE THEREOF MGAM, GALE, GMDS USP2 2548/4885CA1 4074/4885CA2 4010/4885

“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.