SCHEMBL9164871

SCHEMBL9164871

CC(O)C(C)(C)/C=C/C1CCC(C)C1(C)C

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
SCHEMBL9163169 0.75
SCHEMBL9163172 0.75
SCHEMBL9165370 0.74
SCHEMBL111378 0.74
SCHEMBL1172267 0.68
SCHEMBL8806984 0.68
SCHEMBL8805103 0.68
SCHEMBL8807346 0.67
SCHEMBL8807351 0.67
SCHEMBL8806036 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0466019-B1 Derivatives of dihydro campholenic aldehyde GIVAUDAN ROURE INT (CH) 1995-03-22 EP claimed
US-5288701-A Derivatives of dihydrocampholenic aldehyde GIVAUDAN-ROURE CORPORATION (US) 1994-02-22 US claimed
EP-0466019-A2 Derivatives of dihydro campholenic aldehyde GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1992-01-15 EP claimed
JP-5246917-A None JP disclosed
EP-0466019-B1 Derivatives of dihydro campholenic aldehyde GIVAUDAN ROURE INT (CH) 1995-03-22 EP disclosed
US-5288701-A Derivatives of dihydrocampholenic aldehyde GIVAUDAN-ROURE CORPORATION (US) 1994-02-22 US disclosed
JP-H05246917-A NOVEL ODORANT SUBSTANCE L GIVAUDAN & CIE SA 1993-09-24 JP disclosed
EP-0466019-A2 Derivatives of dihydro campholenic aldehyde GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1992-01-15 EP disclosed