SCHEMBL852481

SCHEMBL852481

[CH2]C(C=CCC)C=CCCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
CYP3A4 P08684 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
PTGS1 P23219 1/20 0.36
PPARG P37231 1/20 0.36
OPRK1 P41145 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
SPHK2 Q9NRA0 4/20 0.35
SPHK1 Q9NYA1 4/20 0.35
MAPT P10636 3/20 0.35
CETP P11597 3/20 0.35
GMNN O75496 2/20 0.35
LMNA P02545 2/20 0.35
GLA P06280 2/20 0.35
POLB P06746 2/20 0.35
THRB P10828 2/20 0.35
MAPK1 P28482 2/20 0.35
CXCR5 P32302 2/20 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
SCHEMBL22653991 1.00 MEN1 (0.41) MEN1KMT2ACYP3A4ALDH1A1TSHR
SCHEMBL60120 0.86 MEN1 (0.55) MEN1KMT2ACYP3A4ALDH1A1TSHR
SCHEMBL5209281 0.86 TSHR (0.33) MEN1KMT2ACYP3A4TSHR
SCHEMBL28709594 0.84 MEN1 (0.57) MEN1KMT2ACYP3A4ALDH1A1TSHR
SCHEMBL4751225 0.82 MEN1 (0.50) MEN1KMT2ACYP3A4ALDH1A1TSHR
SCHEMBL9331914 0.79 CNR2 (0.39) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL2122857 0.76
SCHEMBL2122861 0.76
SCHEMBL7550524 0.74 MEN1 (0.42) MEN1KMT2ACYP3A4ALDH1A1TSHR
SCHEMBL7550523 0.74 MEN1 (0.42) MEN1KMT2ACYP3A4ALDH1A1TSHR

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 101 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024110905-A1 ANTI-CEA ANTIBODY DRUG CONJUGATES AND METHODS OF USE BEIGENE, LTD. (KY) 2024-05-30 WO disclosed
CN-117878320-A Binder for secondary battery, negative electrode for secondary battery comprising same, and lithium secondary battery comprising same SK新技术株式会社 2024-04-12 CN disclosed
US-11931445-B2 Composition comprising baicalin L'OREAL (FR) 2024-03-19 US disclosed
CN-116892036-A Silver nanocluster catalyst for carbon dioxide conversion, gas diffusion electrode including the same, zero gap reactor including the same, and carbon dioxide conversion method using the same 延世大学校产学协力团 2023-10-17 CN disclosed
EP-3820609-B1 USE OF N-CHELATING RUTHENIUM COMPLEXES IN THE METATHESIS REACTION APEIRON SYNTHESIS SA (PL) 2023-06-28 EP disclosed
US-20230130617-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS RHODES TECHNOLOGIES (US) 2023-04-27 US disclosed
EP-3558253-B1 COMPOSITION COMPRISING BAICALIN OREAL (FR) 2022-12-28 EP disclosed
EP-4103578-A1 NOVEL MRNA 5'-END CAP ANALOGS MODIFIED WITHIN PHOSPHATE RESIDUES, RNA MOLECULE INCORPORATING THE SAME, USES THEREOF AND METHOD OF SYNTHESIZING RNA MOLECULE OR PEPTIDE Uniwersytet Warszawski (PL) 2022-12-21 EP disclosed
US-20210380619-A1 Production method of cyclic compounds by olefin metathesis reaction and use of ruthenium catalysts in production of cyclic olefines by olefin metathesis reaction UNIWERSYTET WARSZAWSKI (PL) 2021-12-09 US disclosed
WO-2021162566-A1 NOVEL MRNA 5'-END CAP ANALOGS MODIFIED WITHIN PHOSPHATE RESIDUES, RNA MOLECULE INCORPORATING THE SAME, USES THEREOF AND METHOD OF SYNTHESIZING RNA MOLECULE OR PEPTIDE UNIWERSYTET WARSZAWSKI (PL) 2021-08-19 WO disclosed
WO-2005035500-A2 THERAPEUTIC AGENTS USEFUL FOR TREATING PAIN EURO-CELTIQUE S.A. (LU) 2005-04-21 WO disclosed
EP-1519751-A2 COMPOSITIONS COMPRISING PANTHETINE FOR THE TREATMENT OF DYSLIPIDEMIA Esperion Therapeutics Inc. (US) 2005-04-06 EP disclosed
EP-1487436-A1 COMBINATION THERAPY FOR TREATING, PREVENTING OR MANAGING PROLIFERATIVE DISORDERS AND CANCERS Signal Pharmaceuticals, Inc. (US) 2004-12-22 EP disclosed
US-20040116423-A1 5-Aryltetrazole compounds, compositions thereof, and uses therefor INOTEK PHARMACEUTICALS CORPORATION 2004-06-17 US disclosed
WO-2004029044-A1 PYRIMIDINE COMPOUNDS AS THERAPEUTIC AGENTS EURO-CELTIQUE, S.A. (LU) 2004-04-08 WO disclosed
WO-2004009563-A1 5-ARYLTETRAZOLE COMPOUNDS, COMPOSITIONS THEREOF, AND USES THEREFOR INOTEK PHARMACEUTICALS CORPORATION (US) 2004-01-29 WO disclosed
US-20040019208-A1 5-Aryltetrazole Compounds, compositions thereof, and uses therefor INOTEK PHARMACEUTICALS CORPORATION 2004-01-29 US disclosed
WO-2004004774-A2 COMPOSITIONS COMPRISING PANTHETINE FOR THE TREATMENT OF DYSLIPIDEMIA ESPERION THERAPEUTICS, INC. (US) 2004-01-15 WO disclosed
EP-1375482-A1 BENZAMIDINE DERIVATIVE Sankyo Company, Limited (JP) 2004-01-02 EP disclosed
WO-2003075917-A1 COMBINATION THERAPY FOR TREATING, PREVENTING OR MANAGING PROLIFERATIVE DISORDERS AND CANCERS SIGNAL PHARMACEUTICALS, INC. (US) 2003-09-18 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 (4 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-11931445-B2 Composition comprising baicalin KRT18, S100A6, DSG1 MEN1 1651/4885KMT2A 4129/4885CYP3A4 2421/4885
US-20210380619-A1 Production method of cyclic compounds by olefin metathesis reaction and use of ruthenium catalysts in production of cyclic olefines by olefin metathesis reaction COASY, POR, SQLE MEN1 896/4885KMT2A 4647/4885CYP3A4 54/4885
US-20230130617-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS OPRK1, OPRM1, OPRD1 MEN1 4481/4885KMT2A 3486/4885CYP3A4 50/4885
US-20040019208-A1 5-Aryltetrazole Compounds, compositions thereof, and uses therefor CASP5, NLRP3, LITAF MEN1 3398/4885KMT2A 3800/4885CYP3A4 721/4885

“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.