SCHEMBL26733242

SCHEMBL26733242

CC1=CC(C)(C)CCC1C(=O)CC(C)C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC25A5 P05141 1/20 0.35
▸ SRD5A2 P31213 4/20 0.33
▸ ACHE P22303 1/20 0.33
▸ SRD5A1 P18405 1/20 0.32
▸ ADORA2B P29275 3/20 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
SCHEMBL10728113 0.86 — —
SCHEMBL10735540 0.83 — —
SCHEMBL11351771 0.78 APLNR (0.30) —
SCHEMBL10731461 0.78 PTPN2 (0.33) —
SCHEMBL11350346 0.73 ATM (0.36) —
SCHEMBL3420184 0.72 — —
SCHEMBL110140 0.71 RARA (0.32) —
SCHEMBL7557961 0.67 PTPN2 (0.40) —
SCHEMBL8674249 0.67 PTPN2 (0.40) —
SCHEMBL1305369 0.67 PTPN2 (0.40) —

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
WO-2023213922-A1 PRECURSORS FOR THE CONTROLLED RELEASE OF α,β-UNSATURATED ALDEHYDES OR KETONES AND OTHER HIGH IMPACT FRAGRANCE SUBSTANCES SYMRISE AG (DE) 2023-11-09 — — WO disclosed
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