SCHEMBL5390040

SCHEMBL5390040

CC(C)C1(OCCCO)CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.32
▸ CYP4A11 Q02928 1/20 0.32

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
SCHEMBL583686 0.79 CYP1A2 (0.34) —
SCHEMBL21689096 0.75 — —
SCHEMBL1617542 0.75 CYP1A2 (0.32) —
SCHEMBL16077751 0.69 ALDH1A1 (0.32) —
SCHEMBL22236883 0.69 — —
SCHEMBL8738806 0.69 MME (0.31) —
SCHEMBL1616027 0.69 TSHR (0.33) —
Propylene Glycol SCHEMBL27341660 0.68 TDP1 (0.42) —
SCHEMBL11399118 0.68 CYP4F2 (0.37) CYP4F2CYP4A11
SCHEMBL8738525 0.68 MME (0.30) —

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-2007092811-A2 SIALAGOGUE BASED ORAL CARE PRODUCTS WHITEHILL ORAL TECHNOLOGIES, INC. (US) 2007-08-16 — — WO claimed
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