SCHEMBL5080377

SCHEMBL5080377

C1=CC1.C1=CCC=C1

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
SCHEMBL3964279 1.00
SCHEMBL1112264 1.00
SCHEMBL9377 1.00
SCHEMBL10587966 1.00
SCHEMBL9736213 1.00
SCHEMBL1112267 1.00
SCHEMBL1112269 1.00
SCHEMBL9408651 1.00
SCHEMBL21356519 1.00
SCHEMBL29352339 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1597968-B1 Complexes and delivery methods for the safe and convenient storage, transport and application of compounds for inhibiting the ethylene response in plants AGROFRESH INC (US) 2008-05-28 EP disclosed