SCHEMBL7628039

SCHEMBL7628039

CC[C@H](C)[C@@H](C(=O)N[C@H]1CCOC1=O)N(C)C[C@@H](NC[C@@H](N)CS)[C@@H](C)CC

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
SCHEMBL7628171 0.88
SCHEMBL6056479 0.88
SCHEMBL6056399 0.86
SCHEMBL6056413 0.86
SCHEMBL6056406 0.86
SCHEMBL6056513 0.84 FNTB (0.39)
SCHEMBL14537266 0.84
SCHEMBL8399440 0.84
SCHEMBL9067777 0.83 CYP1A2 (0.36)
SCHEMBL5891962 0.80 FNTB (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997001275-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-01-16 WO claimed
US-5326773-A Prodrug enzyme inhibitors MERCK & CO., INC. (US) 1994-07-05 US claimed
US-20020006967-A1 METHODS OF TREATMENT OF OCULAR NEOVASCULARIZATION CAMPOCHIARO PETER A (US) 2002-01-17 US disclosed
US-6160015-A ADMINISTERING TO MAMMAL A FARNESYL PROTEIN TRANSFERASE INHIBITOR UNIVERSITY OF CINCINNATI (US) 2000-12-12 US disclosed
EP-0840605-A4 COMPOUNDS USEFUL IN THE TREATMENT OF NEUROFIBROMATOSIS UNIV CINCINNATI (US) 2000-05-10 EP disclosed
WO-1998057654-A1 METHODS FOR TREATMENT OF OCULAR NEOVASCULARIZATION JOHNS HOPKINS UNIVERSITY (US) 1998-12-23 WO disclosed
EP-0840605-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEUROFIBROMATOSIS University of Cincinnati (US) 1998-05-13 EP disclosed
EP-0836383-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-04-22 EP disclosed
WO-1997002817-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEUROFIBROMATOSIS UNIVERSITY OF CINCINNATI (US) 1997-01-30 WO disclosed
WO-1997001275-A1 COMBINATIONS OF INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-01-16 WO disclosed
US-5536750-A ANTITUMOR MERCK & CO., INC. (US) 1996-07-16 US disclosed
EP-0668856-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE. MERCK & CO INC (US) 1995-11-22 EP disclosed
EP-0668856-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1995-08-30 EP disclosed
US-5326773-A Prodrug enzyme inhibitors MERCK & CO., INC. (US) 1994-07-05 US disclosed
WO-1994010137-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1994-05-11 WO disclosed