SCHEMBL892874

SCHEMBL892874

COC(=O)C(C)[C]=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7645726 0.76
SCHEMBL968440 0.76
SCHEMBL13575067 0.76
SCHEMBL2905542 0.76
SCHEMBL10637203 0.74 SMN1; SMN2 (0.43)
SCHEMBL1191194 0.74
SCHEMBL8782930 0.74 SMN1; SMN2 (0.46)
SCHEMBL13399646 0.74
SCHEMBL6354724 0.73
SCHEMBL10805452 0.73 SMN1; SMN2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9573887-B2 Naphthalene derivative DAITO CHEMIX CORPORATION (JP) 2017-02-21 US claimed
JP-4709387-B2 2011-06-22 JP claimed
JP-4709386-B2 2011-06-22 JP claimed
EP-1150676-B1 ACYL DERIVATIVES OF 4-DEMETHYLPENCLOMEDINE, USE THEREOF AND PREPARATION THEREOF SOUTHERN RES INST (US) 2010-08-11 EP claimed
EP-1143970-B1 PYRIDINE COMPOUNDS, USE AND PREPARATION THEREOF SOUTHERN RES INST (US) 2010-07-21 EP claimed
US-7560459-B2 Substituted sulfamate anticonvulsant derivatives JANSSEN PHARMACEUTICA, N.V. (BE) 2009-07-14 US claimed
US-7060725-B2 Substituted sulfamate anticonvulsant derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-13 US claimed
US-20060058373-A1 Novel substituted sulfamate anticonvulsant derivatives ABDEL-MAGID AHMED 2006-03-16 US claimed
EP-1143970-A4 PYRIDINE COMPOUNDS, USE AND PREPARATION THEREOF SOUTHERN RES INST (US) 2005-07-27 EP claimed
EP-1506212-A2 NOVEL SUBSTITUTED SULFAMATE ANTICONVULSANT DERIVATIVES Ortho-McNeil Pharmaceutical, Inc. (US) 2005-02-16 EP claimed
WO-2000043010-A1 ACYL DERIVATIVES OF 4-DEMETHYLPENCLOMEDINE, USE THEREOF AND PREPARATION THEREOF SOUTHERN RESEARCH INSTITUTE (US) 2000-07-27 WO claimed
JP-2000509029-A 2000-07-18 JP claimed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 EP claimed
US-5932598-A NOVEL SUBSTITUTED SULFONAMIDE COMPOUNDS USEFUL AS PRODRUGS; ADMINISTERING TO TREAT INFLAMMATION-ASSOCIATED PAIN DUE TO CANCER, DENTAL PAIN; CYCLOOXYGENASE-2 INHIBITORS G. D. SEARLE & CO. (US) 1999-08-03 US claimed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 WO claimed
EP-0892791-A1 SUBSTITUTED BENZENESULFONAMIDE DERIVATIVES AS PRODRUGS OF COX-2 INHIBITORS G.D. SEARLE & CO. (US) 1999-01-27 EP claimed
WO-1997038986-A1 SUBSTITUTED BENZENESULFONAMIDE DERIVATIVES AS PRODRUGS OF COX-2 INHIBITORS G.D. SEARLE & CO. (US) 1997-10-23 WO claimed
EP-0162877-A1 Method to titrate enzymes. FLORK MICHEL (FR) 1985-12-04 EP claimed
WO-1985002404-A1 NEW PEPTIDE DERIVATIVES, PREPARATION PROCESS THEREOF AND UTILIZATION THEREOF AS BIOLOGICAL REAGENTS FLORK MICHEL 1985-06-06 WO claimed
US-4419522-A ANTITUMOR AGENTS CHINOIN GYOGYSZER VEGYESZETI TERMEKEK GYARA RT. (HU) 1983-12-06 US claimed