SCHEMBL20897828

SCHEMBL20897828

CCCCCCCCCCCCCCCCCCNC(=S)SCCCCCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
EPHX1 P07099 8/20 0.47
CASP2 P42575 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
NAAA Q02083 1/20 0.40
GBA1 P04062 3/20 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
SCHEMBL28158701 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL28107291 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL28883654 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL28037036 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL20897312 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL28359053 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL31122197 1.00 KEAP1 (0.50) KEAP1NFE2L2EPHX1CASP2ZDHHC20
Hydrochloric Acid SCHEMBL8084045 0.98 KEAP1 (0.49) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL20897754 0.98 KEAP1 (0.49) KEAP1NFE2L2EPHX1CASP2ZDHHC20
SCHEMBL29121138 0.98 KEAP1 (0.49) KEAP1NFE2L2EPHX1CASP2ZDHHC20

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
EP-3694951-B1 SEMICONDUCTING LIGHT EMITTING MATERIAL MERCK PATENT GMBH (DE) 2023-12-13 EP disclosed
CN-111201302-B Semiconductor luminescent material 默克专利股份有限公司 2023-07-18 CN disclosed
CN-110643415-B Open gear oil composition using regenerated base oil and preparation method thereof 新疆福克油品股份有限公司 2022-07-29 CN disclosed
US-20210130684-A1 SEMICONDUCTING LIGHT EMITTING MATERIAL MERCK PATENT GMBH (DE) 2021-05-06 US disclosed
EP-3694951-A1 SEMICONDUCTING LIGHT EMITTING MATERIAL Merck Patent GmbH (DE) 2020-08-19 EP disclosed
CN-111201302-A Semiconductor luminescent material 默克专利股份有限公司 2020-05-26 CN disclosed
CN-110643415-A Open gear oil composition using regenerated base oil and preparation method thereof 新疆福克油品股份有限公司 2020-01-03 CN disclosed
WO-2019072882-A1 SEMICONDUCTING LIGHT EMITTING MATERIAL MERCK PATENT GMBH (DE) 2019-04-18 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 (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-20210130684-A1 SEMICONDUCTING LIGHT EMITTING MATERIAL CRY1, CRY2, NES KEAP1 1134/4885NFE2L2 186/4885EPHX1 2705/4885

“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.