SCHEMBL20943370

SCHEMBL20943370

CC(C)(C)OC(=O)C(CCCCCCCC(=O)OCc1ccccc1)(CCCCCCCC(=O)OCc1ccccc1)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
MAPK1 P28482 2/20 0.44
EPHX2 P34913 1/20 0.42
LMNA P02545 1/20 0.41
SYK P43405 1/20 0.40
MBOAT4 Q96T53 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38

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
SCHEMBL20943360 1.00 ALDH1A1 (0.44) ALDH1A1L3MBTL1MAPK1EPHX2LMNA
SCHEMBL22465770 0.99 ALDH1A1 (0.45) ALDH1A1L3MBTL1MAPK1EPHX2LMNA
SCHEMBL24678178 0.97 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPK1EPHX2LMNA
SCHEMBL24678051 0.97 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPK1EPHX2LMNA
SCHEMBL24678110 0.97 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPK1EPHX2LMNA
SCHEMBL24678074 0.97 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPK1EPHX2LMNA
SCHEMBL20943365 0.95 MBOAT4 (0.46) ALDH1A1L3MBTL1MAPK1EPHX2MBOAT4
SCHEMBL20943336 0.95 MBOAT4 (0.46) ALDH1A1L3MBTL1MAPK1EPHX2MBOAT4
SCHEMBL17381294 0.95 MBOAT4 (0.46) ALDH1A1L3MBTL1MAPK1EPHX2MBOAT4
SCHEMBL20943404 0.95 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPK1EPHX2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3476832-B1 CATIONIC LIPID EISAI R&D MAN CO LTD (JP) 2023-04-19 EP disclosed
EP-3733647-B1 CATIONIC LIPID EISAI R&D MAN CO LTD (JP) 2022-06-15 EP disclosed
EP-3733647-B1 CATIONIC LIPID EISAI R&D MAN CO LTD (JP) 2022-06-15 EP disclosed
US-10947193-B2 Cationic lipid EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-03-16 US disclosed
US-10947193-B2 Cationic lipid EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-03-16 US disclosed
EP-3733647-A1 CATIONIC LIPID Eisai R&D Management Co., Ltd. (JP) 2020-11-04 EP disclosed
EP-3733647-A1 CATIONIC LIPID Eisai R&D Management Co., Ltd. (JP) 2020-11-04 EP disclosed
US-20200308111-A1 Cationic Lipid EISAI R&D MANAGEMENT CO., LTD. (JP) 2020-10-01 US disclosed
US-20200308111-A1 Cationic Lipid EISAI R&D MANAGEMENT CO., LTD. (JP) 2020-10-01 US disclosed
US-20190218180-A1 Cationic Lipid EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-07-18 US disclosed
US-20190218180-A1 Cationic Lipid EISAI R&D MANAGEMENT CO., LTD. (JP) 2019-07-18 US disclosed
EP-3476832-A1 CATIONIC LIPID Eisai R&D Management Co., Ltd. (JP) 2019-05-01 EP disclosed
EP-3476832-A1 CATIONIC LIPID Eisai R&D Management Co., Ltd. (JP) 2019-05-01 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 (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-20200308111-A1 Cationic Lipid NPC1L1, NPC1, LPCAT1 ALDH1A1 1890/4885L3MBTL1 146/4885MAPK1 1456/4885
US-20190218180-A1 Cationic Lipid NPC1L1, NPC1, LPCAT1 ALDH1A1 1462/4885L3MBTL1 344/4885MAPK1 1519/4885
US-10947193-B2 Cationic lipid NPC1L1, NPC1, LPCAT1 ALDH1A1 1890/4885L3MBTL1 146/4885MAPK1 1456/4885

“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.