SCHEMBL9868411

SCHEMBL9868411

CC(CC(=O)Cl)CC(=O)Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
TSHR P16473 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
TP53 P04637 2/20 0.35
CA2 P00918 1/20 0.35
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL2784952 0.89 SLC22A6 (0.39) ALDH1A1TDP1SMN1; SMN2
SCHEMBL9652062 0.89 ALDH1A1 (0.50) ALDH1A1TSHRTDP1
SCHEMBL2784955 0.89 SLC22A6 (0.39) ALDH1A1TDP1SMN1; SMN2
SCHEMBL20232410 0.85
SCHEMBL3381726 0.85
SCHEMBL839656 0.85
SCHEMBL9724921 0.85
SCHEMBL7980233 0.83
SCHEMBL27946985 0.83
SCHEMBL7710987 0.83

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
EP-4306524-A2 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS PureTech LYT, Inc. (US) 2024-01-17 EP disclosed
CN-117122721-A Sponge 贵州省农作物品种资源研究所 2023-11-28 CN disclosed
US-20230338552-A1 LIPID PRODRUGS OF NEUROSTEROIDS PURETECH LYT, INC. (US) 2023-10-26 US disclosed
US-20210300962-A1 LIPID PRODRUGS OF PREGNANE NEUROSTEROIDS AND USES THEREOF SEAPORT THERAPEUTICS, INC. 2021-09-30 US disclosed
WO-2021159021-A1 LIPID PRODRUGS OF NEUROSTEROIDS PURETECH LYT, INC. (US) 2021-08-12 WO disclosed
US-20200390777-A1 LIPID PRODRUGS OF MYCOPHENOLIC ACID AND USES THEREOF SEAPORT THERAPEUTICS, INC. 2020-12-17 US disclosed
WO-2020028787-A1 LIPID PRODRUGS OF PREGNANE NEUROSTEROIDS AND USES THEREOF PureTech Health LLC (US) 2020-02-06 WO disclosed
CN-105669970-B Polyamide-based expandable flame retardant carbon forming agent and its preparation method and application of the main chain containing piperazine structure 四川大学 2018-11-02 CN disclosed
US-5039773-A Toner and developer compositions with thermotropic liquid crystalline polymers XEROX CORPORATION (US) 1991-08-13 US disclosed
US-4891293-A Toner and developer compositions with thermotropic liquid crystalline polymers XEROX CORPORATION (US) 1990-01-02 US 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-20230338552-A1 LIPID PRODRUGS OF NEUROSTEROIDS CYP21A2, CYP46A1, CYP17A1 ALDH1A1 1218/4885TSHR 1372/4885TDP1 1452/4885
US-20200390777-A1 LIPID PRODRUGS OF MYCOPHENOLIC ACID AND USES THEREOF MALT1, CYP2B6, LIPA ALDH1A1 959/4885TSHR 2734/4885TDP1 1969/4885
US-20210300962-A1 LIPID PRODRUGS OF PREGNANE NEUROSTEROIDS AND USES THEREOF CYP21A2, CYP46A1, CYP17A1 ALDH1A1 1430/4885TSHR 1457/4885TDP1 1706/4885

“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.