SCHEMBL4968692

SCHEMBL4968692

N#C[C@H]1CC2C=C[C@H]1C2

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
SCHEMBL4967809 1.00
SCHEMBL4966380 1.00
SCHEMBL539149 1.00 KDM4E (0.33)
SCHEMBL200610 1.00
SCHEMBL4966691 1.00
SCHEMBL4968723 1.00
SCHEMBL4967540 1.00 KDM4E (0.33)
SCHEMBL4968794 1.00
Cyclopentene SCHEMBL7160463 0.88
SCHEMBL678190 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966381-A2 METHOD FOR THE ENZYMATIC PRODUCTION OF 5-NORBORNEN-2-CARBOXYLIC ACID BASF SE (DE) 2008-09-10 EP claimed
WO-2007071578-A2 METHOD FOR PRODUCING 5-NORBORNEN-2-CARBOXYLIC ACID FROM 5-NORBORNEN-2-CARBONITRILE USING AN ARYLACETONITRILASE BASF SE (DE) 2007-06-28 WO claimed