SCHEMBL11376830

SCHEMBL11376830

O=C1CC=CCC(=O)CC=CC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL11376825 1.00 TRIM24 (0.31) TRIM24TRIM33CYP1A2
SCHEMBL52489 1.00
Methane SCHEMBL29266080 0.96
Iodide SCHEMBL11339547 0.96
Methylamine SCHEMBL8994444 0.89
SCHEMBL1334117 0.84
Cyclopentanone SCHEMBL2797347 0.83 TRIM24 (0.62) TRIM24TRIM33
SCHEMBL11192500 0.80
SCHEMBL11220570 0.80
SCHEMBL489453 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4249018-A Synthesis of citric acid or citrates MILES LABORATORIES, INC. (US) 1981-02-03 US claimed
US-4249018-A Synthesis of citric acid or citrates MILES LABORATORIES, INC. (US) 1981-02-03 US disclosed
US-4249018-A Synthesis of citric acid or citrates MILES LABORATORIES, INC. (US) 1981-02-03 US disclosed