SCHEMBL5634786

SCHEMBL5634786

O=[C]C12C=CC(CC1)C2

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
SCHEMBL6233735 0.86
SCHEMBL4987430 0.78
SCHEMBL302733 0.78
SCHEMBL11025010 0.65
SCHEMBL31096364 0.64
SCHEMBL28838001 0.61
SCHEMBL10613859 0.61
SCHEMBL899228 0.61
SCHEMBL9317793 0.61
SCHEMBL162584 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660493-A1 PEPTIDYL HETEROCYCLIC KETONE DERIVATIVES AND PREPARATION PROCESSES JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP claimed
WO-2005023804-A1 PEPTIDYL HETEROCYCLIC KETONE DERIVATIVES AND PREPARATION PROCESSES JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-17 WO claimed
US-20050059607-A1 Process for preparing peptidyl heterocyclic ketone derivatives JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-17 US claimed
US-20030008829-A1 Peptidyl heterocyclic ketones useful as tryptase inhibitors COSTANZO MICHAEL J (US) 2003-01-09 US claimed
EP-0571579-B1 METHOD OF PRODUCTION OF POLYMERS AND COPOLYMERS OF CYCLOALKENE OF NORBORNENE TYPE CHEMOPETROL A S (CS) 1998-04-01 EP claimed
US-5455318-A Metathetical polymerization in presence of catalyst based on tungsten compound reacted with sterically hindered amine and solution of cocatalyst CHEMOPETROL, S.P. LITVINOV, VYZKUMNY USTAV MAKROMOLEKULARNI CHEMIE (CS) 1995-10-03 US claimed
EP-0571579-A1 METHOD OF PRODUCTION OF POLYMERS AND COPOLYMERS OF CYCLOALKENE OF NORBORNENE TYPE Chemopetrol, a.s (CS) 1993-12-01 EP claimed
WO-1993012158-A1 METHOD OF PRODUCTION OF POLYMERS AND COPOLYMERS OF CYCLOALKENE OF NORBORNENE TYPE CHEMOPETROL, S.P. LITVÍNOV VY^´ZKUMNY^´ ÚSTAV MAKROMOLEKULÁRNÍ CHEMIE (CS) 1993-06-24 WO claimed
JP-4230341-A None JP disclosed
US-7205384-B2 Process for preparing peptidyl heterocyclic ketone derivatives ORTHO-MCNEIL PHARMACEUTICAL INC. (US) 2007-04-17 US disclosed
US-7132418-B2 Peptidyl heterocyclic ketones useful as tryptase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2006-11-07 US disclosed
EP-1660493-A1 PEPTIDYL HETEROCYCLIC KETONE DERIVATIVES AND PREPARATION PROCESSES JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP disclosed
WO-2005023804-A1 PEPTIDYL HETEROCYCLIC KETONE DERIVATIVES AND PREPARATION PROCESSES JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-17 WO disclosed
US-20050059607-A1 Process for preparing peptidyl heterocyclic ketone derivatives JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-17 US disclosed
WO-2000044733-A1 PEPTIDYL HETEROCYCLIC KETONES USEFUL AS TRYPTASE INHIBITORS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2000-08-03 WO disclosed
EP-0571579-B1 METHOD OF PRODUCTION OF POLYMERS AND COPOLYMERS OF CYCLOALKENE OF NORBORNENE TYPE CHEMOPETROL A S (CS) 1998-04-01 EP disclosed
US-5455318-A Metathetical polymerization in presence of catalyst based on tungsten compound reacted with sterically hindered amine and solution of cocatalyst CHEMOPETROL, S.P. LITVINOV, VYZKUMNY USTAV MAKROMOLEKULARNI CHEMIE (CS) 1995-10-03 US disclosed
EP-0571579-A1 METHOD OF PRODUCTION OF POLYMERS AND COPOLYMERS OF CYCLOALKENE OF NORBORNENE TYPE Chemopetrol, a.s (CS) 1993-12-01 EP disclosed
WO-1993012158-A1 METHOD OF PRODUCTION OF POLYMERS AND COPOLYMERS OF CYCLOALKENE OF NORBORNENE TYPE CHEMOPETROL, S.P. LITVÍNOV VY^´ZKUMNY^´ ÚSTAV MAKROMOLEKULÁRNÍ CHEMIE (CS) 1993-06-24 WO disclosed
JP-H04230341-A POLYMERIZABLE OXIDATION INHIBITOR, AND POLYOLEFIN AND POLYMERIZATION METHOD FOR PRODUCING POLYOLEFIN STAMICARBON BV 1992-08-19 JP disclosed