SCHEMBL25224364

SCHEMBL25224364

C=CCOCC1C(=O)N(CC=C)C(COCC=C)C(=O)N1CC=C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
POLB P06746 1/20 0.36
PKM P14618 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 1/20 0.35
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL9851968 0.73 ALDH1A1 (0.36) ALDH1A1POLBPKMCTDSP1TDP1
SCHEMBL9851966 0.73 ALDH1A1 (0.36) ALDH1A1POLBPKMCTDSP1TDP1
SCHEMBL25230784 0.70 ALDH1A1 (0.58) ALDH1A1POLBMAPTL3MBTL1
SCHEMBL7203140 0.68 CYP3A4 (0.34) ALDH1A1PKMCYP3A4MAPTL3MBTL1
SCHEMBL24591674 0.68 CYP3A4 (0.46) ALDH1A1CYP3A4MAPTL3MBTL1
SCHEMBL23054680 0.64 CYP3A4 (0.42) ALDH1A1CYP3A4MAPTL3MBTL1
SCHEMBL17360679 0.64 CYP3A4 (0.42) ALDH1A1CYP3A4MAPTL3MBTL1
SCHEMBL17360665 0.64 CYP3A4 (0.42) ALDH1A1CYP3A4MAPTL3MBTL1
SCHEMBL8418363 0.63 CYP3A4 (0.46) ALDH1A1CYP3A4MAPTL3MBTL1
SCHEMBL30479506 0.63 CYP3A4 (0.41) ALDH1A1POLBCYP3A4MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336575-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-10 US disclosed
CN-118401498-A Polythiol compound and process for producing the same 汉高股份有限及两合公司 2024-07-26 CN disclosed
EP-4198028-B1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-07-17 EP disclosed
WO-2023110271-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO. KGAA (DE) 2023-06-22 WO disclosed
EP-4198028-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF Henkel AG & Co. KGaA (DE) 2023-06-21 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 (1 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-20240336575-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF VRK2, VRK1, PTMS ALDH1A1 4626/4885POLB 3290/4885PKM 589/4885

“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.