SCHEMBL1208073

SCHEMBL1208073

CCCN(C(=O)C(O)C(C)(C)CO)C(CN)SSC(CN)N(CCC)C(=O)C(O)C(C)(C)CO

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.35
KCNH2 Q12809 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
SCHEMBL5593796 0.74 PTGS1 (0.31) PTGS1KCNH2
SCHEMBL22236866 0.65 PTGS1 (0.50) PTGS1KCNH2
SCHEMBL18339356 0.65 PTGS1 (0.40) PTGS1KCNH2
SCHEMBL3316071 0.65 PTGS1 (0.36) PTGS1KCNH2
SCHEMBL3316077 0.65 PTGS1 (0.36) PTGS1KCNH2
SCHEMBL10076382 0.60 PTGS1 (0.47) PTGS1KCNH2
SCHEMBL5329840 0.60 PTGS1 (0.47) PTGS1KCNH2
Ethylenediamine SCHEMBL28334089 0.60 PTGS1 (0.43) PTGS1KCNH2
SCHEMBL17664728 0.60 PTGS1 (0.40) PTGS1KCNH2
Pantoic Acid SCHEMBL213982 0.58 PTGS1 (0.48) PTGS1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240092775-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FELIQS CORPORATION (JP) 2024-03-21 US disclosed
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof OCUTERRA THERAPEUTICS, INC. (US) 2023-06-27 US disclosed
EP-3925959-A1 FLUORINATED DERIVATIVES OF 3-(2-OXO-3-(3-(5,6,7,8-TETRAHYDRO-1,8-NAPHTHYRIDIN-2-YL)PROPYL)IMIDAZOLIDIN-1-YL)PROPANOIC ACID AND USES THEREOF OcuTerra Therapeutics, Inc. (US) 2021-12-22 EP disclosed
US-20210346400-A1 TREATMENT OF FIBROSIS USING FXR LIGANDS INTERCEPT PHARMACEUTICALS, INC. 2021-11-11 US disclosed
US-20210277000-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FELIQS CORPORATION (JP) 2021-09-09 US disclosed
EP-3259271-B1 FLUORINATED DERIVATIVES OF 3-(2-OXO-3-(3-(5,6,7,8-TETRAHYDRO-1,8-NAPHTHYRIDIN-2-YL)PROPYL)IMIDAZOLIDIN-1-YL)PROPANOIC ACID AND USES THEREOF SCIFLUOR LIFE SCIENCES INC (US) 2021-05-05 EP disclosed
US-10987362-B2 Treatment of fibrosis using FXR ligands INTERCEPT PHARMACEUTICALS, INC. (US) 2021-04-27 US disclosed
US-20200397803-A9 TREATMENT OF FIBROSIS USING FXR LIGANDS INTERCEPT PHARMACEUTICALS, INC. 2020-12-24 US disclosed
EP-2712617-B2 Treatment of fibrosis using Fxr ligands INTERCEPT PHARMACEUTICALS INC (US) 2020-11-18 EP disclosed
EP-3175855-B1 TREATMENT OF FIBROSIS USING FXR LIGANDS INTERCEPT PHARMACEUTICALS INC (US) 2020-07-15 EP disclosed
US-20070292501-A1 CHEWABLE SOFT GELATIN CAPSULES SOFT GEL TECHNOLOGIES, INC. 2007-12-20 US disclosed
WO-2006132879-A2 SOFT GEL CAPSULES CONTAINING POLYMETHOXYLATED FLAVONES AND PALM OIL TOCOTRIENOLS SOFT GEL TECHNOLOGIES, INC. (US) 2006-12-14 WO disclosed
US-20060069070-A1 Treatment of fibrosis using FXR ligands INTERCEPT PHARMACEUTICALS, INC. (US) 2006-03-30 US disclosed
US-20060003947-A1 Soft gel capsules containing polymethoxylated flavones and palm oil tocotrienols THE CIT GROUP/CREDIT FINANCE, INC. 2006-01-05 US disclosed
US-20050101565-A1 Pharmaceutical compositions and methods for treating, preventing, and managing cholesterol, dyslipidemia, and related disorders ESPERION THERAPEUTICS, INC. 2005-05-12 US disclosed
EP-1519751-A2 COMPOSITIONS COMPRISING PANTHETINE FOR THE TREATMENT OF DYSLIPIDEMIA Esperion Therapeutics Inc. (US) 2005-04-06 EP disclosed
WO-2004004774-A2 COMPOSITIONS COMPRISING PANTHETINE FOR THE TREATMENT OF DYSLIPIDEMIA ESPERION THERAPEUTICS, INC. (US) 2004-01-15 WO disclosed
EP-0323855-B1 Pantethine as inhibitory agent of hepatic fibrosis DAIICHI SEIYAKU CO (JP) 1994-04-13 EP disclosed
US-4937266-A ADMINISTERING PANTETHINE DAIICHI SEIYAKU CO., LTD. (JP) 1990-06-26 US disclosed
EP-0323855-A2 Pantethine as inhibitory agent of hepatic fibrosis DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1989-07-12 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 (6 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-20240092775-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FFAR3, FFAR2, FFAR1 PTGS1 484/4885KCNH2 2012/4885
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof FFAR3, FFAR2, FFAR1 PTGS1 484/4885KCNH2 2012/4885
US-20050101565-A1 Pharmaceutical compositions and methods for treating, preventing, and managing cholesterol, dyslipidemia, and related disorders PCSK9, PCSK7, HMGCR PTGS1 1883/4885KCNH2 1240/4885
US-20060003947-A1 Soft gel capsules containing polymethoxylated flavones and palm oil tocotrienols TTPA, PLA2G10, GSTO1 PTGS1 105/4885KCNH2 3938/4885
US-20070292501-A1 CHEWABLE SOFT GELATIN CAPSULES GMPS, PIGS, GYS1 PTGS1 76/4885KCNH2 3908/4885
US-20210277000-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FFAR3, FFAR2, FFAR1 PTGS1 484/4885KCNH2 2012/4885

“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.