SCHEMBL11062359

SCHEMBL11062359

CC1CC(=O)C=C(OC(C)C)C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.33
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CRBN Q96SW2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 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
SCHEMBL16525833 0.73 CRBN (0.31) CRBNALDH1A1MAPK1
SCHEMBL7383326 0.73 ACHE (0.37) ACHEL3MBTL1CRBNALDH1A1MAPK1
SCHEMBL4258014 0.72 ALDH1A1 (0.37) CRBNALDH1A1MAPK1
SCHEMBL7362200 0.71 MAPT (0.42) ACHE
SCHEMBL16522668 0.69 MAPK1 (0.31) MAPK1
SCHEMBL8101389 0.68 MAPT (0.55) TSHRALDH1A1
SCHEMBL11065102 0.66 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL1042381 0.66
SCHEMBL14609061 0.64
SCHEMBL15588771 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4432378-A ORGANOLEPTIC; TOBACCO; FOODS; DETERGENTS; COSMETICS FRITZSCHE, DODGE & OLCOTT, INC. (US) 1984-02-21 US disclosed
US-4326996-A FOR PERFUMES FRITZSCHE DODGE & OLCOTT INC. (US) 1982-04-27 US disclosed