SCHEMBL18506916

SCHEMBL18506916

CC(=O)CCC1=CCC(=C(C)C)CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
IAPP P10997 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
SCHEMBL8154660 0.75 ALOX15 (0.39) ALDH1A1
SCHEMBL9812097 0.72 ALDH1A1 (0.43) ALDH1A1
SCHEMBL17508425 0.72
SCHEMBL2220979 0.70 ALDH1A1 (0.49) ALDH1A1
SCHEMBL8923638 0.70
SCHEMBL17524285 0.69
SCHEMBL14527664 0.67 ALDH1A1 (0.35) ALDH1A1IAPP
SCHEMBL6750481 0.66 PAOX (0.45) ALDH1A1
Terpinolene SCHEMBL3669469 0.66 MET (0.32)
Hydrochloric Acid SCHEMBL8432445 0.64 LMNA (0.41)

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-3130579-A1 CONJUGATES OF ISOPERILLYL ALCOHOL Neonc Technologies Inc. (US) 2017-02-15 EP disclosed