SCHEMBL5986730

SCHEMBL5986730

CC1=CCC(C(=O)C(=O)O)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CCR2 P41597 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Hydrochloric Acid SCHEMBL11523697 0.82 MEN1 (0.33) ALDH1A1SMN1; SMN2CCR2
SCHEMBL2426198 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2424052 0.73 USP2 (0.31)
SCHEMBL6655928 0.73
SCHEMBL2425336 0.72 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2
SCHEMBL2430645 0.72 SLC25A5 (0.36)
SCHEMBL19668014 0.70 KDM4E (0.30) ALDH1A1
SCHEMBL2425243 0.70 RIPK1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL2425589 0.70
SCHEMBL10707987 0.70 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060111270-A1 Ketocampholenic acid derivatives and their use in fragrance applications AROMAGEN CORPORATION 2006-05-25 US claimed
EP-1534660-A1 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOR APPLICATIONS Aromagen Corporation (US) 2005-06-01 EP claimed
WO-2004013079-A1 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOUR APPLICATIONS AROMAGEN CORPORATION (US) 2004-02-12 WO claimed
US-20060111270-A1 Ketocampholenic acid derivatives and their use in fragrance applications AROMAGEN CORPORATION 2006-05-25 US disclosed
US-20060111270-A1 Ketocampholenic acid derivatives and their use in fragrance applications AROMAGEN CORPORATION 2006-05-25 US disclosed
EP-1534660-A1 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOR APPLICATIONS Aromagen Corporation (US) 2005-06-01 EP disclosed
EP-1534660-A1 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOR APPLICATIONS Aromagen Corporation (US) 2005-06-01 EP disclosed
WO-2004013079-A8 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOUR APPLICATIONS AROMAGEN CORP (US) 2004-04-29 WO disclosed
WO-2004013079-A1 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOUR APPLICATIONS AROMAGEN CORPORATION (US) 2004-02-12 WO disclosed
WO-2004013079-A1 KETOCAMPHOLENIC ACID DERIVATIVES AND THEIR USE IN FRAGRANCE AND FLAVOUR APPLICATIONS AROMAGEN CORPORATION (US) 2004-02-12 WO disclosed