SCHEMBL11084272

SCHEMBL11084272

O=C1/C=C/C=C\CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
TRIM24 O15164 1/20 0.32
TRIM33 Q9UPN9 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
SCHEMBL28890799 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL11084278 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL18691952 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL28416138 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL18691951 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL1009833 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL11084269 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL1009832 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL19743473 1.00 ALDH1A1 (0.56) ALDH1A1TRIM24TRIM33
SCHEMBL1011477 0.98 ALDH1A1 (0.54) ALDH1A1TRIM24TRIM33

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
EP-0107738-A2 Process and intermediates for the production of periplanone-B Herculite Products, Inc. (US) 1984-05-09 EP disclosed
US-4339388-A Synthesis of periplanone-B STILL W CLARK 1982-07-13 US disclosed