SCHEMBL4122661

SCHEMBL4122661

CC1=CC(C)(O)C=C[CH]1

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
SCHEMBL2240230 0.74
SCHEMBL4122556 0.71
SCHEMBL4421364 0.70
SCHEMBL5730705 0.67
SCHEMBL29403097 0.65
SCHEMBL8528075 0.63
SCHEMBL823252 0.60
SCHEMBL18903229 0.59
SCHEMBL29154114 0.59
SCHEMBL8976094 0.56

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
US-20090011862-A1 Golf Ball with Negative Hardness Gradient Core JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2009-01-08 US disclosed