SCHEMBL2208741

SCHEMBL2208741

Cc1ncsc1CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
PKM P14618 1/20 0.52
ALDH1A1 P00352 4/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SLC6A3 Q01959 1/20 0.44
GABRR1 P24046 1/20 0.39
MAPT P10636 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37
VHL P40337 1/20 0.36
AGBL2 Q5U5Z8 1/20 0.36
KAT2B Q92831 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL25522414 0.84 ALDH1A1 (0.50) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL3091813 0.82 ALDH1A1 (0.48) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL1074418 0.81 ALDH1A1 (0.56) KDM4EPKMALDH1A1KMT2AMEN1
Bicarbonate SCHEMBL27829730 0.80 KDM4E (0.52) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL25562762 0.79 ALDH1A1 (0.46) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL7779172 0.78 ALDH1A1 (0.53) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL27400464 0.78 SMN1; SMN2 (0.46) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL27650993 0.76 GABRA5 (0.43) KDM4EPKMALDH1A1KMT2AMEN1
Acetic Acid SCHEMBL3851421 0.76 ALDH1A1 (0.55) KDM4EPKMALDH1A1KMT2AMEN1
SCHEMBL4236238 0.75 KDM4E (0.43) KDM4EPKMALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118234414-A Nut butter imitation produced from separate components 航行食品股份有限公司 2024-06-21 CN claimed
CN-113699077-A Microbial degradation method of vomitoxin 河南工业大学 2021-11-26 CN disclosed
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
CN-103189370-A Triazole derivatives as ligands for GABA receptors HOFFMANN LA ROCHE 2013-07-03 CN disclosed
EP-1689256-B1 FOOD PRODUCTS CONTAINING A FRUIT COMPONENT TAKASAGO PERFUMERY CO LTD (JP) 2011-07-27 EP disclosed
EP-1351934-B1 NAPHTHALENE DERIVATIVES WHICH BIND TO THE EP4 RECEPTOR GLAXO GROUP LTD (GB) 2007-08-29 EP disclosed
US-20070092623-A1 Food products containing a fruit component TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-04-26 US disclosed
EP-1689256-A1 FOOD PRODUCTS CONTAINING A FRUIT COMPONENT Takasago International Corporation (JP) 2006-08-16 EP disclosed
US-6924297-B2 Naphathalene derivatives which bind to the EP4 receptor SMITHKLINE BEECHAM CORPORATION (US) 2005-08-02 US disclosed
WO-2005048743-A1 FOOD PRODUCTS CONTAINING A FRUIT COMPONENT TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-02 WO disclosed
US-20040102508-A1 Naphathalene derivatives which bind to the ep4 receptor SMITHKLINE BEECHAM CORPORATION 2004-05-27 US disclosed
EP-1351934-A1 NAPHTHALENE DERIVATIVES WHICH BIND TO THE EP4 RECEPTOR GLAXO GROUP LIMITED (GB) 2003-10-15 EP disclosed
WO-2002050032-A1 NAPHTHALENE DERIVATIVES WHICH BIND TO THE EP4 RECEPTOR GLAXO GROUP LIMITED (GB) 2002-06-27 WO disclosed
EP-0397048-A2 Process for the preparation of 2-mercapto-4-methyl-1,3-thiazol-5-yl acetic acid and its esters HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-14 EP disclosed
US-4665066-A BACTERICIDES ELI LILLY AND COMPANY (US) 1987-05-12 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 (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-20040102508-A1 Naphathalene derivatives which bind to the ep4 receptor PTGER4, PTGER1, PTGER3 KDM4E 3281/4885PKM 2285/4885ALDH1A1 1587/4885

“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.