SCHEMBL31329156

SCHEMBL31329156

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
SCHEMBL21981041 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 3 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
CN-119977963-A Tetrahydropyrane (THP) -substituted bicyclic pyrimidinedione compounds 迈奥卡迪亚公司 2025-05-13 — — CN disclosed
CN-113056465-B Tetrahydropyrane (THP) -substituted bicyclic pyrimidinedione compounds 迈奥卡迪亚公司 2025-01-28 — — CN disclosed
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