SCHEMBL17188463

SCHEMBL17188463

CCCC(=O)C(=[N+]=[N-])C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
FAAH O00519 2/20 0.38
ALDH1A1 P00352 5/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GLO1 Q04760 1/20 0.34
FFAR3 O14843 2/20 0.33
HDAC3 O15379 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
EGLN1 Q9GZT9 1/20 0.32
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 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
SCHEMBL13499946 0.89 FAAH (0.46) CES2CES1FAAHALDH1A1NPSR1
SCHEMBL16810208 0.87 FAAH (0.53) CES2CES1FAAHALDH1A1NPSR1
SCHEMBL2255510 0.84 SOAT1 (0.39) FAAHALDH1A1NPSR1GLO1TSHR
SCHEMBL17981546 0.84 FAAH (0.38) CES2CES1FAAHALDH1A1NPSR1
SCHEMBL2204826 0.83 ALDH1A1 (0.43) ALDH1A1NPSR1GLO1TSHRLMNA
SCHEMBL16808974 0.82 ALDH1A1 (0.36) FAAHALDH1A1NPSR1GLO1TSHR
SCHEMBL26885023 0.82 CES2 (0.42) CES2CES1ALDH1A1FFAR3HDAC3
SCHEMBL10644070 0.82 ALDH1A1 (0.36) FAAHALDH1A1NPSR1GLO1TSHR
SCHEMBL2262673 0.82 CA1 (0.38) FAAHALDH1A1NPSR1GLO1TSHR
SCHEMBL17964096 0.81 GAA (0.52) ALDH1A1NPSR1GLO1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250197381-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-06-19 US disclosed
US-12247021-B2 Substituted tetrahydrofurans as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-03-11 US disclosed
EP-4506001-A2 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2025-02-12 EP disclosed
US-20240391907-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-11-28 US disclosed
EP-4069691-B1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMA (US) 2024-09-18 EP disclosed
US-11919887-B2 Substituted tetrahydrofurans as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-03-05 US disclosed
US-11834441-B2 Substituted tetrahydrofurans as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-12-05 US disclosed
US-11834441-B2 Substituted tetrahydrofurans as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-12-05 US disclosed
US-20230286961-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2023-09-14 US disclosed
US-20230286961-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2023-09-14 US disclosed
EP-4069691-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2022-10-12 EP disclosed
CN-114945566-A Substituted tetrahydrofurans as sodium channel modulators 沃泰克斯药物股份有限公司 2022-08-26 CN disclosed
US-20210198241-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2021-07-01 US disclosed
WO-2021113627-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2021-06-10 WO disclosed
EP-3064585-A1 ENGINEERING AND OPTIMIZATION OF IMPROVED SYSTEMS, METHODS AND ENZYME COMPOSITIONS FOR SEQUENCE MANIPULATION The Broad Institute, Inc. (US) 2016-09-07 EP disclosed
US-9163078-B2 Regulators of NFAT CHILDREN'S MEDICAL CENTER CORPORATION (US) 2015-10-20 US disclosed
CN-1277819-C Process for producing azetidinone compounds TAKASAGO PERFUMERY CO LTD (JP) 2006-10-04 CN disclosed
CN-1610663-A Process for producing azetidinone compounds TAKASAGO PERFUMERY CO LTD (JP) 2005-04-27 CN 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 (7 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-12247021-B2 Substituted tetrahydrofurans as modulators of sodium channels TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885
US-20230286961-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885
US-11834441-B2 Substituted tetrahydrofurans as modulators of sodium channels TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885
US-20210198241-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885
US-20240391907-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885
US-11919887-B2 Substituted tetrahydrofurans as modulators of sodium channels TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885
US-20250197381-A1 SUBSTITUTED TETRAHYDROFURANS AS MODULATORS OF SODIUM CHANNELS TRPV1, TRPA1, SCN2B CES2 2108/4885CES1 3926/4885FAAH 933/4885

“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.