SCHEMBL21981041

SCHEMBL21981041

CC(C)(C)[S@+]([O-])NC(c1cccc(F)c1)C(F)(F)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.40
▸ HDAC7 Q8WUI4 1/20 0.40
▸ HDAC5 Q9UQL6 1/20 0.40
▸ DPP4 P27487 1/20 0.38
▸ DPP7 Q9UHL4 1/20 0.38
▸ CNR2 P34972 1/20 0.37
▸ MTOR P42345 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ OPRM1 P35372 4/20 0.36
▸ OPRL1 P41146 3/20 0.36
▸ CXCR1 P25024 1/20 0.36
▸ CXCR2 P25025 1/20 0.36
▸ CYP26A1 O43174 1/20 0.35
▸ CTSL P07711 2/20 0.35
▸ CTSB P07858 2/20 0.35
▸ CTSS P25774 2/20 0.35
▸ CTSK P43235 2/20 0.35
▸ MEN1 O00255 1/20 0.34

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
SCHEMBL31329156 1.00 HDAC4 (0.40) HDAC4HDAC7HDAC5DPP4DPP7
SCHEMBL21981039 1.00 HDAC4 (0.40) HDAC4HDAC7HDAC5DPP4DPP7
SCHEMBL21981040 1.00 HDAC4 (0.40) HDAC4HDAC7HDAC5DPP4DPP7
SCHEMBL29332823 0.88 HDAC4 (0.38) HDAC4HDAC7HDAC5CNR2MTOR
SCHEMBL17841446 0.87 GABRB1 (0.37) CTSLCTSSCTSKMEN1LMNA
SCHEMBL17841444 0.87 GABRB1 (0.37) CTSLCTSSCTSKMEN1LMNA
SCHEMBL17841447 0.87 GABRB1 (0.37) CTSLCTSSCTSKMEN1LMNA
SCHEMBL23112571 0.84 CTSL (0.37) HDAC4HDAC7HDAC5DPP4DPP7
SCHEMBL23112568 0.84 CTSL (0.37) HDAC4HDAC7HDAC5DPP4DPP7
SCHEMBL23112570 0.84 CTSL (0.37) HDAC4HDAC7HDAC5DPP4DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4736855-A2 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. (US) 2026-05-06 — — EP disclosed
EP-4464321-B1 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MYOKARDIA INC (US) 2026-01-21 — — EP disclosed
US-20250282779-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES MYOKARDIA INC (US) 2025-09-11 — — US disclosed
US-12344607-B2 Substituted 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine-2,4-diones for treating cardiac diseases MyoKardia, Inc. (US) 2025-07-01 — — US disclosed
EP-4464321-A2 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. (US) 2024-11-20 — — EP disclosed
EP-3873904-B1 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MYOKARDIA INC (US) 2024-07-10 — — EP disclosed
US-20240025894-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES SANOFI-AVENTIS RECHERCHE & DEVELOPPEMENT (FR) 2024-01-25 — — US disclosed
US-20220340569-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES MYOKARDIA INC (US) 2022-10-27 — — US disclosed
US-20220106314-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES MYOKARDIA INC (US) 2022-04-07 — — US disclosed
EP-3873904-A1 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. (US) 2021-09-08 — — EP disclosed
CN-113056465-A Tetrahydropyran (THP) -substituted bicyclic pyrimidinedione compounds 迈奥卡迪亚公司 2021-06-29 — — CN disclosed
US-11034693-B2 Substituted 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine-2,4-diones for treating cardiac diseases MyoKardia, Inc. (US) 2021-06-15 — — US disclosed
US-20200165247-A1 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2020-05-28 — — 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 (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-20200165247-A1 TETRAHYDROPYRAN (THP)-SUBSTITUTED BICYCLIC-PYRIMIDINEDIONE COMPOUNDS THPO, TNNI3, TNNT2 HDAC4 1345/4885HDAC7 2348/4885HDAC5 1678/4885
US-20250282779-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES DHPS, THPO, TNNI3 HDAC4 1471/4885HDAC7 1494/4885HDAC5 1238/4885
US-20220106314-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES DHPS, THPO, TNNI3 HDAC4 1471/4885HDAC7 1494/4885HDAC5 1238/4885
US-20220340569-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES DHPS, THPO, TNNI3 HDAC4 1471/4885HDAC7 1494/4885HDAC5 1238/4885
US-20240025894-A1 SUBSTITUTED 5,6,7,8-TETRAHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4-DIONES FOR TREATING CARDIAC DISEASES DHPS, THPO, TNNI3 HDAC4 1471/4885HDAC7 1494/4885HDAC5 1238/4885
US-12344607-B2 Substituted 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine-2,4-diones for treating cardiac diseases DHPS, THPO, TNNI3 HDAC4 1532/4885HDAC7 720/4885HDAC5 882/4885
US-11034693-B2 Substituted 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine-2,4-diones for treating cardiac diseases TNNT2, TNNI3, DHPS HDAC4 2954/4885HDAC7 1578/4885HDAC5 1630/4885

“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.

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