SCHEMBL6512199

SCHEMBL6512199

COc1ccc(COCCCBr)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.59
TDP1 Q9NUW8 1/20 0.59
IDO1 P14902 3/20 0.50
AGXT P21549 2/20 0.50
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
APP P05067 7/20 0.46
CALM1 P0DP23 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAOB P27338 1/20 0.43
GBA1 P04062 1/20 0.41
UGCG Q16739 1/20 0.41
GBA2 Q9HCG7 1/20 0.41
LTA4H P09960 1/20 0.41

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
SCHEMBL4728877 0.95 L3MBTL1 (0.62) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL16727734 0.93 L3MBTL1 (0.65) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL27089918 0.93 L3MBTL1 (0.65) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL1355360 0.93 L3MBTL1 (0.65) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL1427941 0.89 TDP1 (0.54) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL15233070 0.85 TDP1 (0.63) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL8499580 0.84 IDO1 (0.61) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL7228686 0.84 TDP1 (0.50) L3MBTL1TDP1IDO1CALM1MAOB
SCHEMBL30565724 0.82 L3MBTL1 (0.56) L3MBTL1TDP1IDO1AGXTCA1
SCHEMBL9022493 0.81 L3MBTL1 (0.59) L3MBTL1TDP1IDO1AGXTCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360163-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2024-10-31 US disclosed
US-12049474-B2 Nucleoside prodrugs and uses related thereto EMORY UNIVERSITY (US) 2024-07-30 US disclosed
WO-2024008941-A1 NEW SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS LES LABORATOIRES SERVIER (FR) 2024-01-11 WO disclosed
US-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2022-09-22 US disclosed
US-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2022-09-22 US disclosed
EP-4017499-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO Emory University (US) 2022-06-29 EP disclosed
CN-114502172-A Nucleoside prodrugs and related uses thereof 爱默蕾大学 2022-05-13 CN disclosed
WO-2021035214-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2021-02-25 WO disclosed
WO-2007096261-A2 PROCESS FOR THE PREPARATION OF DIOXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-30 WO disclosed
US-20070197615-A1 Process for the preparation of the PPAR alpha agonist NS-220 HOFFMANN-LA ROCHE INC. 2007-08-23 US disclosed
EP-1144408-A1 SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION PIERRE FABRE MEDICAMENT (FR) 2001-10-17 EP disclosed
WO-2000043391-A1 SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION PIERRE FABRE MEDICAMENT (FR) 2000-07-27 WO disclosed
CN-1044911-C Process for preparing prodrug IGEN INC (US) 1999-09-01 CN disclosed
CN-1217335-A Method for preparing precursor medicine IGEN INC (US) 1999-05-26 CN disclosed
EP-0746336-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1996-12-11 EP disclosed
EP-0746336-A4 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN INC (US) 1996-07-26 EP disclosed
US-5296492-A Certain chroman derivatives useful for treating symptoms caused by contraction of smooth muscles, circulatory diseases or epilepsy NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1994-03-22 US disclosed
CN-1070409-A Prodrugs activated by targetted catalytic proteins IGEN INC (US) 1993-03-31 CN disclosed
WO-1993002703-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1993-02-18 WO disclosed
EP-0518342-A1 Chroman derivatives Nippon Kayaku Kabushiki Kaisha (JP) 1992-12-16 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 (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-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 L3MBTL1 4216/4885TDP1 1205/4885IDO1 1110/4885
US-20240360163-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 L3MBTL1 4216/4885TDP1 1205/4885IDO1 1110/4885
US-12049474-B2 Nucleoside prodrugs and uses related thereto PNPO, GSTO1, CYP2C18 L3MBTL1 4216/4885TDP1 1205/4885IDO1 1110/4885
US-20070197615-A1 Process for the preparation of the PPAR alpha agonist NS-220 PPARD, PPARA, PPARG L3MBTL1 4870/4885TDP1 4281/4885IDO1 3348/4885

“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.