SCHEMBL11042255

SCHEMBL11042255

CCC1(CC)C(C(=O)O)C1(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.35
APLNR P35414 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 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
SCHEMBL9640365 0.79
SCHEMBL3092368 0.72 FFAR3 (0.32) FFAR3
SCHEMBL18173594 0.67 MAPK1 (0.35) APLNR
SCHEMBL4888774 0.65 APLNR (0.41) FFAR3APLNRPOLB
Hydrochloric Acid SCHEMBL8617904 0.63 APLNR (0.39) FFAR3APLNR
Methane SCHEMBL3337389 0.63 APLNR (0.39) FFAR3APLNR
Bicarbonate SCHEMBL22557980 0.58 FFAR3 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL4813121 0.58
Propionic Acid SCHEMBL16594334 0.58
Bicarbonate SCHEMBL3075415 0.58

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
EP-0036385-B1 INSECTICIDAL VAPOUR-EMITTING COMPOSITIONS ON THE BASIS OF PYRETHRINOIDS Airwick AG (CH) 1984-05-02 EP claimed